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Sample records for 4-methyl reaction products

  1. 40 CFR 721.10190 - Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... diamine and phenol, reaction products with 4-methyl-2-pentanone (generic). 721.10190 Section 721.10190... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10190 Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2-pentanone...

  2. 40 CFR 721.10190 - Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... diamine and phenol, reaction products with 4-methyl-2-pentanone (generic). 721.10190 Section 721.10190... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10190 Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2-pentanone...

  3. 40 CFR 721.10190 - Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... diamine and phenol, reaction products with 4-methyl-2-pentanone (generic). 721.10190 Section 721.10190... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10190 Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2-pentanone...

  4. 40 CFR 721.10190 - Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... diamine and phenol, reaction products with 4-methyl-2-pentanone (generic). 721.10190 Section 721.10190... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10190 Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2-pentanone...

  5. 40 CFR 721.10190 - Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... diamine and phenol, reaction products with 4-methyl-2-pentanone (generic). 721.10190 Section 721.10190... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10190 Formaldehyde, polymer with aliphatic diamine and phenol, reaction products with 4-methyl-2-pentanone...

  6. 40 CFR 721.10188 - Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Fatty acids, tall-oil, reaction... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10188 Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine (generic)....

  7. 40 CFR 721.10188 - Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Fatty acids, tall-oil, reaction... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10188 Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine (generic)....

  8. 40 CFR 721.10188 - Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Fatty acids, tall-oil, reaction... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10188 Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine (generic)....

  9. 40 CFR 721.10188 - Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Fatty acids, tall-oil, reaction... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10188 Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine (generic)....

  10. 40 CFR 721.10188 - Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Fatty acids, tall-oil, reaction... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10188 Fatty acids, tall-oil, reaction products with 4-methyl-2-pentanone and aliphatic polyamine (generic)....

  11. 40 CFR 721.1645 - Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono[(C10-16-alkyloxy)methyl...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...-, reaction products with oxirane mono derivatives and 2,2,4(or 2,4,4)-trimethyl-1,6-hexanediamine. 721.1645... Substances § 721.1645 Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono derivatives and 2... to reporting. (1) The chemical substance benzenesulfonic acid, 4-methyl-, reaction products...

  12. 40 CFR 721.1645 - Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono[(C10-16-alkyloxy)methyl...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...-, reaction products with oxirane mono derivatives and 2,2,4(or 2,4,4)-trimethyl-1,6-hexanediamine. 721.1645... Substances § 721.1645 Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono derivatives and 2... to reporting. (1) The chemical substance benzenesulfonic acid, 4-methyl-, reaction products...

  13. 40 CFR 721.1645 - Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono[(C10-16-alkyloxy)methyl...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...-, reaction products with oxirane mono derivatives and 2,2,4(or 2,4,4)-trimethyl-1,6-hexanediamine. 721.1645... Substances § 721.1645 Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono derivatives and 2... to reporting. (1) The chemical substance benzenesulfonic acid, 4-methyl-, reaction products...

  14. 40 CFR 721.1645 - Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono[(C10-16-alkyloxy)methyl...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... to reporting. (1) The chemical substance benzenesulfonic acid, 4-methyl-, reaction products with...-, reaction products with oxirane mono derivatives and 2,2,4(or 2,4,4)-trimethyl-1,6-hexanediamine. 721.1645... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  15. 40 CFR 721.1645 - Benzenesulfonic acid, 4-methyl-, reaction products with oxirane mono[(C10-16-alkyloxy)methyl...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... to reporting. (1) The chemical substance benzenesulfonic acid, 4-methyl-, reaction products with...-, reaction products with oxirane mono derivatives and 2,2,4(or 2,4,4)-trimethyl-1,6-hexanediamine. 721.1645... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  16. Isomerization and decomposition reactions in the pyrolysis of branched hydrocarbons: 4-methyl-1-pentyl radical.

    PubMed

    McGivern, W Sean; Awan, Iftikhar A; Tsang, Wing; Manion, Jeffrey A

    2008-07-31

    The kinetics of the decomposition of 4-methyl-1-pentyl radicals have been studied from 927-1068 K at pressures of 1.78-2.44 bar using a single pulse shock tube with product analysis. The reactant radicals were formed from the thermal C-I bond fission of 1-iodo-4-methylpentane, and a radical inhibitor was used to prevent interference from bimolecular reactions. 4-Methyl-1-pentyl radicals undergo competing decomposition and isomerization reactions via beta-bond scission and 1, x-hydrogen migrations (x = 4, 5), respectively, to form short-chain radicals and alkenes. Major alkene products, in decreasing order of concentration, were propene, ethene, isobutene, and 1-pentene. The observed products are used to validate a RRKM/master equation (ME) chemical kinetics model of the pyrolysis. The presence of the branched methyl moiety has a significant impact on the observed reaction rates relative to analogous reaction rates in straight-chain radical systems. Systems that result in the formation of substituted radical or alkene products are found to be faster than reactions that form primary radical and alkene species. Pressure-dependent reaction rate constants from the RRKM/ME analysis are provided for all four H-transfer isomers at 500-1900 K and 0.1-1000 bar pressure for all of the decomposition and isomerization reactions in this system. PMID:18613654

  17. Production of low-density poly (4-methyl-1-pentene) foam via phase inversion from binary solvent/nonsovent systems

    SciTech Connect

    Simandl, R.F.; Robinson, D.N.; Bolinger, W.L.; Davis, W.E.

    1991-11-01

    Phase inversion from durene/naphthalene, durene/tmpdo, and durene/hexadecanol binary solvent/nonsolvent systems produced well interconnected, radiographically homogeneous, open-celled poly (4- methyl-1-pentene) or pmp foams. These foams ranged in density from 5 to 50 mg/cm{sup 2}. Foam homogeneity and casting efficiency were dependent on casting scheme, durene quality, solvent-to-nonsolvent ratio, and quench temperature. Foam density tracked linearly with dissolved-polymer content. Homogeneous, ultralow-density (5 to 6 mg/cm{sup 3}) foams were produced by using a 49/51 durene/naphthalene solvent eutectic. Foam hardness or firmness tracked somewhat linearly with foam density. Foams with densities above 20 mg/cm{sup 3} were too fragile to handle without damage.

  18. Loss of CclA, required for histone 3 lysine 4 methylation, decreases growth but increases secondary metabolite production in Aspergillus fumigatus

    PubMed Central

    Lee, Seul; Dagenais, Taylor R.T.; Andes, David R.; Kontoyiannis, Dimitrios P.

    2013-01-01

    Secondary metabolite (SM) production in filamentous fungi is mechanistically associated with chromatin remodeling of specific SM clusters. One locus recently shown to be involved in SM suppression in Aspergillus nidulans was CclA, a member of the histone 3 lysine 4 methylating COMPASS complex. Here we examine loss of CclA and a putative H3K4 demethylase, HdmA, in the human pathogen Aspergillus fumigatus. Although deletion of hdmA showed no phenotype under the conditions tested, the cclA deletant was deficient in tri- and di-methylation of H3K4 and yielded a slowly growing strain that was rich in the production of several SMs, including gliotoxin. Similar to deletion of other chromatin modifying enzymes, ΔcclA was sensitive to 6-azauracil indicating a defect in transcriptional elongation. Despite the poor growth, the ΔcclA mutant had wild-type pathogenicity in a murine model and the Toll-deficient Drosophila model of invasive aspergillosis. These data indicate that tri- and di-methylation of H3K4 is involved in the regulation of several secondary metabolites in A. fumigatus, however does not contribute to pathogenicity under the conditions tested. PMID:23638376

  19. The origin and fate of 4-methyl steroid hydrocarbons. I. Diagenesis of 4-methyl sterenes

    NASA Astrophysics Data System (ADS)

    Wolff, George A.; Lamb, Neil A.; Maxwell, James R.

    1986-03-01

    Treatment of 4-methylcholest-4-ene under mild acid conditions at low temperatures gives chemical evidence for certain features seen in the distributions of sedimentary 4-methyl steroid hydrocarbons, and further indicates that many low temperature diagenetic reactions of steroids are explicable in terms of acid catalysed rearrangements. Specifically, the results provide: (i) Indirect evidence that the 4-ene skeleton is a key intermediate in the dehydration of 4-methyl stanols in sediments. (ii) An explanation for the distribution of 4-methyl sterenes and A-nor sterenes in the lacustrine Messel shale (Eocene). (iii) An explanation for the presence of 4β-methyl steranes in relatively immature sedimentary rocks, despite the precursor stanols having the 4α-methyl configuration. With increasing maturity in the Paris Basin shales (Lower Toarcian), the less stable 4β-methyl steranes decrease gradually in abundance relative to their 4α-methyl counterparts, at a rate fairly similar to the change in pristane stereochemistry.

  20. Individual variation of (S)-4-methyl-3-heptanone in heads of braconid wasp, Leiophron uniformis, and Pogonomyrmex ants indicates costs of semiochemical production

    Technology Transfer Automated Retrieval System (TEKTRAN)

    (S)-4-methyl-3-heptanone is known as an alarm pheromone released from the mandibular glands in heads of red harvester ants (Pogonomyrmex spp.). Using GC-MS, we found that both sexes of the braconid wasp Leiophron uniformis, which is a parasitoid of plant bug pests of agricultural crops, contain 2-6 ...

  1. 4-Methyl-1-(4-methylbenzylidene)thio-semicarbazide.

    PubMed

    Li, Yu-Feng

    2010-01-01

    The title compound, C(10)H(13)N(3)S, prepared by the reaction of 4-methyl-benzaldehyde and 4-methyl-thio-semicarbazide, is approximately planar (r.m.s. deviation for the non-H atoms = 0.032 Å). Its conformation is stabilized by an intra-molecular N-H⋯N hydrogen bond, generating an S(5) ring. In the crystal, inversion dimers linked by pairs of N-H⋯S hydrogen bonds occur. Further weak N-H⋯S links connect the dimers into (100) sheets. PMID:21589038

  2. Histone H3 lysine 4 methylation revisited

    PubMed Central

    Kusch, Thomas

    2012-01-01

    Since its discovery more than a decade ago, H3K4 methylation has become synonymous with transcription. We only now have begun to realize that the distinct states of H3K4 methylation have unique distributions and specialized roles in other chromatin-related processes. Here, I discuss recent findings addressing their regulation and functions. PMID:23117820

  3. Developmental immunotoxicity testing of 4-methyl anisole.

    PubMed

    Tonk, Elisa C M; Verhoef, Aart; Gremmer, Eric R; van Loveren, Henk; Piersma, Aldert H

    2015-07-01

    The developmental immunotoxicity of 4-methyl anisole (4MA) was investigated in the rat. Four study designs were used, with either premating or post-weaning onset of exposure, continued to postnatal day 50, and with or without additional oral gavage of pups from postnatal day 10 onward. Reduced litter size (benchmark dose lower confidence limit (BMDL) 80mg/kg bw/day) was the most sensitive developmental parameter, with pup relative organ weight effects observed at similar BMDLs, in the absence of maternal toxicity. Eosinophil numbers were reduced at lower doses (BMDL 16mg/kg bw/day). KLH challenge resulted in increased IL-13 and TNF-α responses, and variably reduced IgG production (BMDL 27mg/kg bw/day). T4 levels were reduced by 11% at maximum with a BMDL of 73mg/kg bw/day. Differences between exposure cohorts were limited and were considered to be without biological significance. This study shows that 4MA induces developmental immunotoxicity at doses below those inducing developmental and general toxicity. These observations being independent of the study designs applied suggest that the post-weaning period, included in all designs, is the most relevant sensitive period for inducing 4MA mediated developmental immunotoxicity. Moreover, this study stresses the importance of including developmental immunotoxicity testing by default in regulatory toxicology. PMID:25882306

  4. Reaction product imaging

    SciTech Connect

    Chandler, D.W.

    1993-12-01

    Over the past few years the author has investigated the photochemistry of small molecules using the photofragment imaging technique. Bond energies, spectroscopy of radicals, dissociation dynamics and branching ratios are examples of information obtained by this technique. Along with extending the technique to the study of bimolecular reactions, efforts to make the technique as quantitative as possible have been the focus of the research effort. To this end, the author has measured the bond energy of the C-H bond in acetylene, branching ratios in the dissociation of HI, the energetics of CH{sub 3}Br, CD{sub 3}Br, C{sub 2}H{sub 5}Br and C{sub 2}H{sub 5}OBr dissociation, and the alignment of the CD{sub 3} fragment from CD{sub 3}I photolysis. In an effort to extend the technique to bimolecular reactions the author has studied the reaction of H with HI and the isotopic exchange reaction between H and D{sub 2}.

  5. Identification and electrophysiological studies of (4 S,5 S)-5-hydroxy-4-methyl-3-heptanone and 4-methyl-3,5-heptanedione in male lucerne weevils

    NASA Astrophysics Data System (ADS)

    Unelius, C. R.; Park, K.-C.; McNeill, M.; Wee, S. L.; Bohman, B.; Suckling, D. M.

    2013-02-01

    An investigation to identify a sex or aggregation pheromone of Sitona discoideus Gyllenhål (Coleoptera: Curculionidae) is presented. Antenna flicking and attraction behaviors evoked by conspecifics of both sexes were recorded in arena bioassays, where attraction of females to males was observed. Air entrainment of both males and females was conducted in separate chambers. Gas chromatographic-mass spectrometric analysis of headspace volatiles revealed that two male-specific compounds, 4-methyl-3,5-heptanedione (major) and (4 S,5 S)-5-hydroxy-4-methyl-3-heptanone (minor), were emitted during the autumnal post-aestivatory flight period. The stereoisomers of the minor component were separated by enantioselective gas chromatography and their absolute configurations assigned by NMR (diastereomers) and the known preference of enantioselective transesterification reactions catalyzed by Candida antarctica lipase B. Electroantennogram and single sensillum recording studies indicate that 4-methyl-3,5-heptanedione as well as all individual stereoisomers of 5-hydroxy-4-methyl-3-heptanone are detected by the antennae of male and female S. discoideus. Further, single sensillum recordings suggest that both sexes of S. discoideus have specialized olfactory receptor neurons (ORNs) for detecting 4-methyl-3,5-heptanedione and different populations of stereoselective ORNs for detecting the stereoisomers of 5-hydroxy-4-methyl-3-heptanone. Some of these stereoselective ORNs appear to be sex-specific in S. discoideus.

  6. Identification and electrophysiological studies of (4S,5S)-5-hydroxy-4-methyl-3-heptanone and 4-methyl-3,5-heptanedione in male lucerne weevils.

    PubMed

    Unelius, C R; Park, K-C; McNeill, M; Wee, S L; Bohman, B; Suckling, D M

    2013-02-01

    An investigation to identify a sex or aggregation pheromone of Sitona discoideus Gyllenhål (Coleoptera: Curculionidae) is presented. Antenna flicking and attraction behaviors evoked by conspecifics of both sexes were recorded in arena bioassays, where attraction of females to males was observed. Air entrainment of both males and females was conducted in separate chambers. Gas chromatographic-mass spectrometric analysis of headspace volatiles revealed that two male-specific compounds, 4-methyl-3,5-heptanedione (major) and (4S,5S)-5-hydroxy-4-methyl-3-heptanone (minor), were emitted during the autumnal post-aestivatory flight period. The stereoisomers of the minor component were separated by enantioselective gas chromatography and their absolute configurations assigned by NMR (diastereomers) and the known preference of enantioselective transesterification reactions catalyzed by Candida antarctica lipase B. Electroantennogram and single sensillum recording studies indicate that 4-methyl-3,5-heptanedione as well as all individual stereoisomers of 5-hydroxy-4-methyl-3-heptanone are detected by the antennae of male and female S. discoideus. Further, single sensillum recordings suggest that both sexes of S. discoideus have specialized olfactory receptor neurons (ORNs) for detecting 4-methyl-3,5-heptanedione and different populations of stereoselective ORNs for detecting the stereoisomers of 5-hydroxy-4-methyl-3-heptanone. Some of these stereoselective ORNs appear to be sex-specific in S. discoideus. PMID:23238636

  7. Reaction products of chlorine dioxide.

    PubMed Central

    Stevens, A A

    1982-01-01

    Inspection of the available literature reveals that a detailed investigation of the aqueous organic chemistry of chlorine dioxide and systematic identification of products formed during water disinfection has not been considered. This must be done before an informed assessment can be made of the relative safety of using chlorine dioxide as a disinfectant alternative to chlorine. Although trihalomethanes are generally not formed by the action of chlorine dioxide, the products of chlorine dioxide treatment of organic materials are oxidized species, some of which also contain chlorine. The relative amounts of species types may depend on the amount of chlorine dioxide residual maintained and the concentration and nature of the organic material present in the source water. The trend toward lower concentrations of chlorinated by-products with increasing ClO2 concentration, which was observed with phenols, has not been observed with natural humic materials as measured by the organic halogen parameter. Organic halogen concentrations have been shown to increase with increasing chlorine dioxide dose, but are much lower than those observed when chlorine is applied. Aldehydes have been detected as apparent by-products of chlorine dioxide oxidation reactions in a surface water that is a drinking water source. Some other nonchlorinated products of chlorine dioxide treatment may be quinones and epoxides. The extent of formation of these moieties within the macromolecular humic structure is also still unknown. PMID:7151750

  8. Genotoxicity testing of Maillard reaction products.

    PubMed

    Shibamoto, T

    1989-01-01

    Since the development of short-term genotoxicity tests such as the Ames assay, the mutagenicity of Maillard reaction products has been tested extensively. Some products have exhibited strong activity. For example, one of the earliest studies demonstrated some mutagenic activity in a dichloromethane extract of a D-glucose/ammonia Maillard model system. Many researchers have attempted to pinpoint the principal chemical(s) of mutagenicity of the Maillard products using various sugar-amino acid browning model systems over last two decades. However, no mutagenic individual Maillard product has been isolated and identified. Nitrite has been also used as a reactant in browning reaction model systems, primarily to investigate the formation of potentially mutagenic or carcinogenic N-nitroso compounds. Recently some potent mutagens isolated from pyrolyzed amino acids or proteins have begun to receive attention as Maillard reaction products. PMID:2675034

  9. Low Energy Nuclear Reaction Products at Surfaces

    NASA Astrophysics Data System (ADS)

    Nagel, David J.

    2008-03-01

    This paper examines the evidence for LENR occurring on or very near to the surface of materials. Several types of experimental indications for LENR surface reactions have been reported and will be reviewed. LENR result in two types of products, energy and the appearance of new elements. The level of instantaneous power production can be written as the product of four factors: (1) the total area of the surface on which the reactions can occur, (2) the fraction of the area that is active at any time, (3) the reaction rate, that is, the number of reactions per unit active area per second, and (4) the energy produced per reaction. Each of these factors, and their limits, are reviewed. A graphical means of relating these four factors over their wide variations has been devised. The instantaneous generation of atoms of new elements can also be written as the product of the first three factors and the new elemental mass produced per reaction. Again, a graphical means of presenting the factors and their results over many orders of magnitude has been developed.

  10. 4-Methyl-3-(arylsulfonyl)furoxans: a new class of potent inhibitors of platelet aggregation.

    PubMed

    Calvino, R; Fruttero, R; Ghigo, D; Bosia, A; Pescarmona, G P; Gasco, A

    1992-08-21

    A series of 4-methyl-3-(arylthio)furoxans were synthesized by oxidation of 1-(arylthio)-2-methylglyoxymes with dinitrogen tetroxide. Reduction with trimethyl phosphite of the furoxan derivatives afforded the corresponding furazans, while oxidation with an equimolar amount of 30% hydrogen peroxide in acetic acid or with an excess of 81% hydrogen peroxide in trifluoroacetic acid afforded the corresponding arylsulfinyl and arylsulfonyl analogues, respectively. All the furoxan and furazan derivatives showed activity as inhibitors of platelet aggregation. 4-Methyl-3-(arylsulfonyl)furoxans were the most potent derivatives of the series. 4-Methyl-3-(phenylsulfonyl)furoxan (10a), one of the most active derivatives, inhibits the AA-induced increase of cytosolic free Ca2+ and production of malondialdehyde. A primary action of the compound on cyclooxygenase is excluded, as a stable epoxymethano analogue of prostaglandin H2 does not reverse the inhibitory effect of 10a. This compound produces a significant increase in cGMP which is likely to cause inhibition at an early stage of the platelet activation pathway. PMID:1324320

  11. Methyl 4-methyl­sulfonyl-2-nitro­benzoate

    PubMed Central

    Hou, Yan-Jun; Chu, Wen-Yi; Sui, Jun; Sun, Zhi-Zhong

    2010-01-01

    The title compound, C9H9NO6S, was prepared by the reaction of methanol and thionyl chloride with 4-methyl­sulfonyl-2-nitro­benzoic acid under mild conditions. The dihedral angle between the nitro group and benzene ring is 21.33 (19)° and that between the carboxyl­ate group and the benzene ring is 72.09 (17)°. The crystal structure is stabilized by weak inter­molecular bifurcated C—H⋯O inter­actions occurring in the (100) plane. PMID:21587895

  12. REACTION PRODUCTS FROM THE CHLORINATION OF SEAWATER

    EPA Science Inventory

    Chemical treatment of natural waters, in particular the use of chlorine as a biocide, modifies the chemistry of these waters in ways that are not fully understood. The research described in this report examined both inorganic and organic reaction products from the chlorination of...

  13. 40 CFR 721.10294 - Cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl-.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...-dimethylethyl)-4-methyl-. 721.10294 Section 721.10294 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10294 Cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl-. (a) Chemical... cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl- (PMN P-11-580; CAS No. 163119-16-2) is subject to...

  14. 40 CFR 721.10294 - Cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl-.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...-dimethylethyl)-4-methyl-. 721.10294 Section 721.10294 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10294 Cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl-. (a) Chemical... cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl- (PMN P-11-580; CAS No. 163119-16-2) is subject to...

  15. 40 CFR 721.10294 - Cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl-.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...-dimethylethyl)-4-methyl-. 721.10294 Section 721.10294 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10294 Cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl-. (a) Chemical... cyclohexanol, 2,6-bis(1,1-dimethylethyl)-4-methyl- (PMN P-11-580; CAS No. 163119-16-2) is subject to...

  16. FT-IR study of the ring-retaining products from the reaction of OH radicals with phenol, o-, m-, and p-cresol

    NASA Astrophysics Data System (ADS)

    Olariu, Romeo Iulian; Klotz, Björn; Barnes, Ian; Becker, Karl Heinz; Mocanu, Raluca

    The ring-retaining products of the OH-initiated degradation of phenol and o-, m-, and p-cresol in the presence of NO x have been investigated and their formation yields determined. The experiments were carried out in a large volume reactor at (298±2) K and 1000 mbar total pressure of synthetic air using FT-IR spectroscopy for the analysis of reactants and products. The products observed and their respective molar yields were: from phenol: 1,2-dihydroxybenzene (80.4±12.1)%, 1,4-benzoquinone (3.7±1.2)% and 2-nitrophenol (5.8±1.0)%; from o-cresol: 3-methyl-1,2-dihydroxybenzene (73.4±14.6)%, methyl-1,4-benzoquinone (6.8±1.0)% and 6-methyl-2-nitrophenol (6.8±1.5)%; from m-cresol: 3-methyl-1,2-dihydroxybenzene (68.6±13.4)%, 4-methyl-1,2-dihydroxybenzene (9.7±2.7)%, methyl-1,4-benzoquinone (11.3±2.5)%, 5-methyl-2-nitrophenol (4.4±1.5)% and 3-methyl-2-nitrophenol (4.3±1.6)% and from p-cresol: 4-methyl-1,2-dihydroxybenzene (64.1±11.3)% and 4-methyl-2-nitrophenol (7.6±2.2)%. Reaction pathways leading to the observed products are proposed and potential ramifications for the atmospheric reaction mechanisms of aromatic hydrocarbons are considered.

  17. Ion transport of Fr nuclear reaction products

    SciTech Connect

    Behr, J.A.; Cahn, S.B.; Dutta, S.B.

    1993-04-01

    Experiments planned for fundamental studies of radioactive atoms in magneto-optic traps require efficient deceleration and transport of nuclear reaction products to energies and locations where they can be trapped. The authors have built a low-energy ion transport system for Francium and other alkalis. A thick Au target is held on a W rod at 45{degrees} to the accelerator beam direction. The heavy-ion fusion reaction 115 MeV {sup 18}O + {sup 197}Au produces {sup 211,210,209}Fr recoil products which are stopped in the target. The target is heated to close to the melting point of Au to allow the Fr to diffuse to the surface, where it is ionized due to Au`s high work function, and is directly extracted by an electrode at 90{degrees} to the accelerator beam direction. The Fr is transported by electrostatic optics {approximately}1 m to a catcher viewed by an {alpha} detector: {ge}15% of the Fr produced in the target reaches the catcher. 2{times}10{sup 5} Fr/sec have been produced at the catcher, yielding at equilibrium a sample of 3x10{sup 7}Fr nuclei. This scheme physically decouples the target diffusion from the surface neutralization process, which can occur at a lower temperature more compatible with the neutral-atom trap.

  18. 2-Amino-5-methyl-pyridinium 4-methyl-benzoate.

    PubMed

    Thanigaimani, Kaliyaperumal; Farhadikoutenaei, Abbas; Arshad, Suhana; Razak, Ibrahim Abdul

    2013-01-01

    The 4-methyl-benzoate anion of the title salt, C6H9N2(+)·C8H7O2(-), is nearly planar, with a dihedral angle of 6.26 (10)° between the benzene ring and the carboxyl-ate group. In the crystal, the protonated N atom and the 2-amino group of the cation are hydrogen bonded to the carboxyl-ate O atoms of the anion via a pair of N-H⋯O hydrogen bonds with an R2(2)(8) ring motif, forming an approximately planar ion pair with a dihedral angle of 9.63 (4)° between the pyridinium and benzene rings. The ion pairs are further connected via N-H⋯O and weak C-H⋯O hydrogen bonds, forming a two-dimensional network parallel to the bc plane. PMID:23476474

  19. Transfer-type products accompanying cold fusion reactions

    SciTech Connect

    Adamian, G.G.; Antonenko, N.V.

    2005-12-15

    Production of nuclei heavier than the target is treated for projectile-target combinations used in cold fusion reactions leading to superheavy nuclei. These products are related to transfer-type or to asymmetry-exit-channel quasifission reactions. The production of isotopes in the transfer-type reactions emitting of {alpha} particles with large energies is discussed.

  20. Production of pesticide metabolites by oxidative reactions.

    PubMed

    Hodgson, E

    1982-08-01

    The cytochrome P-450-dependent monooxygenase system catalyzes a wide variety of oxidations of pesticide chemicals and related compounds. These reactions include epoxidation and aromatic hydroxylation, aliphatic hydroxylation, O-, N- and S-dealkylation, N-oxidation, oxidative deamination, S-oxidation, P-oxidation, desulfuration and ester cleavage and may result in either detoxication or activation of the pesticide. The current status of such reactions, relative to the production, in vivo, of biologically active intermediates in pesticide metabolism is summarized. More recently we have shown that the FAD-containing monooxygenase of mammalian liver (E.C.1.14.13.8), a xenobiotic metabolizing enzyme of broad specificity formerly known as an amine oxidase, is involved in a variety of pesticide oxidations. These include sulfoxidation of organophosphorus insecticides such as phorate and disulfoton, oxidative desulfuration of phosphonate insecticides such as fonofos and oxidation at the phosphorus atom in such compounds as the cotton defoliant, folex. The relative importance of the FAD-containing monooxygenase vis-a-vis the cytochrome P-450-dependent monooxygenase system is discussed, based on in vitro studies on purified enzymes. PMID:7161848

  1. Reactions of uranium hexafluoride photolysis products

    NASA Astrophysics Data System (ADS)

    Lyman, John L.; Laguna, Glenn; Greiner, N. R.

    1985-01-01

    This paper confirms that the ultraviolet photolysis reactions of UF6 in the B band spectral region is simple bond cleavage to UF5 and F. The photolysis products may either recombine to UF6 or the UF5 may dimerize, and ultimately polymerize, to solid UF5 particles. We use four methods to set an upper limit for the rate constant for recombination of kr<2.0×10-12cm3 molecule-1 s-1. We measure the rate constant for UF5 dimerization to be kd=(1.0±0.2)×10-11 cm3 molecule-1 s-1. The principal method employed in these studies is the use of diode lasers to monitor, in real time, the changes in density of the species UF6 and UF5 after laser photolysis of the UF6 gas sample.

  2. Electroweak meson production reaction in the nucleon resonance region

    SciTech Connect

    Sato, Toru

    2015-10-15

    We report on our recent study of the the neutrino-nucleon reaction in the nucleon resonance region. The dynamical reaction model of meson production reaction on the nucleon for the pion and photon induced reaction has been developed in order to investigate the spectrum of nucleon excited state. We have extended this model in order to describe the weak meson production reactions with the πN, ηN, KΛ, KΣ and ππN final states. We also studied the role of the final state interaction in the photon and the neutrino induced pion production reaction on the deuteron around the Δ(1232) resonance region.

  3. Steric course of the rhodium-catalyzed decarbonylation of chiral 4-methyl-[1-3H,2-2H1]pentanal.

    PubMed

    Otsuka, H; Floss, H G

    1987-04-01

    (R)- and (S)-4-methyl-[1-3H,2-2H1]pentanal were prepared from L- and D-leucine via leucic acid and (S)- and (R)-4-methyl-[2-2H1]pentanoic acid. Decarbonylation of these samples with tris-(triphenylphosphine)rhodium chloride followed by Kuhn-Roth oxidation of the resulting 2-methylbutane gave chiral acetic acid of 35% e.e. S and 31% e.e. R configuration, respectively. The decarbonylation reaction thus proceeds with net retention of configuration, possibly accompanied by some racemization. PMID:2955591

  4. Identification of 2-ethyl-4-methyl-3-thiazoline and 2-isopropyl-4-methyl-3-thiazoline for the first time in nature by the comprehensive analysis of sesame seed oil.

    PubMed

    Agyemang, David; Bardsley, Kathryn; Brown, Sharon; Kraut, Kenneth; Psota-Kelty, Linda; Trinnaman, Laurence

    2011-04-01

    Toasted sesame seed oil was comprehensively analyzed. It was extracted using the SAFE (Solvent-Assisted Flavor Evaporation) technique. The extract was analyzed by GC and GC-MS on 2 phases and a total of 87 components were identified, confirmed, and are presented in this paper. The major components were methylpyrazine; 2,5-dimethylpyrazine; 2,6-dimethylpyrazine; 2-ethyl-3,6-dimethylpyrazine; furfuryl alcohol; and guaiacol. In addition, as part of this analysis, 2-ethyl-4-methyl-3-thiazoline and 2-isopropyl-4-methyl-3-thiazoline were confirmed as being present in a natural product for the first time. Their identification, confirmation, and sensory evaluation have been documented here. PMID:21535804

  5. Energy distribution among reaction products. V.

    NASA Technical Reports Server (NTRS)

    Anlauf, K. G.; Horne, D. S.; Macdonald, R. G.; Polanyi, J. C.; Woodall, K. B.

    1972-01-01

    Discussion of three reactions, one point of theoretical interest being the predicted correlation between barrier height and barrier location. The H + Br 2 reaction having a lower activation barrier than H + Cl 2, should have an earlier barrier, and hence a greater percentage attractive energy release and higher efficiency of vibrational excitation. Information is developed concerning the effect of isotopic substitution in the pair of reactions H + Cl 2 and D + Cl 2. The 'arrested relaxation' method was used. Essentially, the method involves reacting two diffuse reagent beams in a reaction vessel with background pressure less than 0.001 torr, and with walls cooled by liquid nitrogen or liquid helium.

  6. Bioavailability of the Phenolic Antioxidant 4-Methyl-2,6-Diisobornylphenol After Oral Administration.

    PubMed

    Chernysheva, G A; Smolyakova, V I; Yanovskaya, E A; Kutchin, A V; Chukicheva, I Yu; Udut, V V; Plotnikov, M B

    2016-08-01

    We compared bioavailability of 4-methyl-2,6-diisobornylphenol after single intragastric administration to rats in a dose of 200 mg/kg in starch suspension and in almond oil. Absorption of 4-methyl-2,6-diisobornylphenol in the gastrointestinal tract after administration in almond oil was much more efficient than after administration in aqueous starch mucus. PMID:27590757

  7. Influence of manufacturing conditions and crop season on the formation of 4-mercapto-4-methyl-2-pentanone in Japanese green tea (sen-cha).

    PubMed

    Kumazawa, Kenji; Kubota, Kikue; Masuda, Hideki

    2005-06-29

    4-Mercapto-4-methyl-2-pentanone is one of the most strongly contributing odorants in the volatile fraction of a Japanese green tea (sen-cha) infusion, and on the basis of the results of an aroma extract dilution analysis, the contribution of this compound to the flavor of the sen-cha infusion varied according to the degree of heating of the tea leaves during the roasting process. The concentration of this odorant in the sen-cha infusion, as with other roasty odorants, increased with the increasing roasting temperature. However, the slope of the increase curve differed with the odor compound, and even if roasting was done at a low temperature, at which the other roasty odorants hardly increased, 4-mercapto-4-methyl-2-pentanone still increased and reached a maximum at 112 degrees C. On the other hand, the amount of 4-mercapto-4-methyl-2-pentanone in sen-cha was a maximum in the first crop, then decreasing in the order of the second and third crops. These results suggested that the amount of 4-mercapto-4-methyl-2-pentanone was closely involved with the quality of sen-cha and that the concentration was dependent on the roasting conditions for the green tea leaves, which might be accompanied by an enzymatic reaction. PMID:15969524

  8. The vibrational spectra and structure of 4-methyl oxaloacetate (carbomethoxypyruvic acid)

    NASA Astrophysics Data System (ADS)

    Schiering, David W.; Katon, J. E.

    1986-04-01

    The vibrational spectra of solid 4-methyl oxalocetate have been recorded. Infrared spectra were collected at ambient and liquid nitrogen temperatures; Raman spectra were collected at ambient temperature only. A tentative vibrational assignment of the solid is proposed based on a dimer structure composed of two enolic monomer units hydrogen bonded through the carboxylic acid group. 4-Methyl oxaloacetate was found to undergo keto—enol tautomerization in solution, and the solvent dependency of this equilibrium was demonstrated.

  9. Products of the Benzene + O(3P) Reaction

    SciTech Connect

    Taatjes, Craig A.; Osborn, David L.; Selby, Talitha M.; Meloni, Giovanni; Trevitt, Adam J.; Epifanovsky, Evgeny; Krylov, Anna I.; Sirjean, Baptiste; Dames, Enoch; Wang, Hai

    2009-12-21

    The gas-phase reaction of benzene with O(3P) is of considerable interest for modeling of aromatic oxidation, and also because there exist fundamental questions concerning the prominence of intersystem crossing in the reaction. While its overall rate constant has been studied extensively, there are still significant uncertainties in the product distribution. The reaction proceeds mainly through the addition of the O atom to benzene, forming an initial triplet diradical adduct, which can either dissociate to form the phenoxy radical and H atom, or undergo intersystem crossing onto a singlet surface, followed by a multiplicity of internal isomerizations, leading to several possible reaction products. In this work, we examined the product branching ratios of the reaction between benzene and O(3P) over the temperature range of 300 to 1000 K and pressure range of 1 to 10 Torr. The reactions were initiated by pulsed-laser photolysis of NO2 in the presence of benzene and helium buffer in a slow-flow reactor, and reaction products were identified by using the multiplexed chemical kinetics photoionization mass spectrometer operating at the Advanced Light Source (ALS) of Lawrence Berkeley National Laboratory. Phenol and phenoxy radical were detected and quantified. Cyclopentadiene and cyclopentadienyl radical were directly identified for the first time. Finally, ab initio calculations and master equation/RRKM modeling were used to reproduce the experimental branching ratios, yielding pressure-dependent rate expressions for the reaction channels, including phenoxy + H, phenol, cyclopentadiene + CO, which are proposed for kinetic modeling of benzene oxidation.

  10. Reaction rate and products for the reaction O/3P/ + H2CO

    NASA Technical Reports Server (NTRS)

    Chang, J. S.; Barker, J. R.

    1979-01-01

    A study of reaction kinetics of O + H2CO in a discharge-flow system using mass spectrometric detection of reactants and products is presented. It was performed under both oxygen-atom-rich and formaldehyde-rich conditions over the 296 to 437 K range, showing that the global bimolecular rate constant is in agreement with other studies. This study differs from others in that the reaction products can be observed, and a substantial yield of a primary reaction product was measured with a mass spectral peak at m/e=44. This suggests that the global reaction rate probably consists of combination, as well as of simple abstraction. For the combination, one hypothesis is that triplet dioxymethylene is formed which polymerizes to triplet formic acid; the vibrationally excited triplet formic acid may decompose to form several sets of products, including HCO + OH and HCO2 + H.

  11. Solid-state proton transfer studies on phototautomerization of 1-phenyl-3-methyl-4-furoyl-5-pyrazolone 4-methyl thiosemicarbazone

    NASA Astrophysics Data System (ADS)

    Zhang, Tao; Liu, Guangfei; Liu, Lang; Jia, Dianzeng; Zhang, Li

    2006-08-01

    A novel keto-enol phototautomeric compound of 1-phenyl-3-methyl-4-(-furoyl)-5-pyrazolone 4-methyl thiosemicarbazone was found to undergo phototautomerization in the crystalline state. The reaction rate constant was studied based on the first-order kinetics curve. Crystal structural analysis and theoretical calculations show that the pyrazolone ring stabilizes in the keto form. The conclusion can be made that its phototautomerization in the crystalline state is associated with a photo-induced intermolecular double-proton-transfer reaction along intermolecular hydrogen bonds N sbnd H⋯O and S⋯H sbnd N leading to a colored tautomer as the compound crystallizes in a hydrogen bonded supramolecular configuration.

  12. Exploiting the reversibility of natural product glycosyltransferase-catalyzed reactions.

    PubMed

    Zhang, Changsheng; Griffith, Byron R; Fu, Qiang; Albermann, Christoph; Fu, Xun; Lee, In-Kyoung; Li, Lingjun; Thorson, Jon S

    2006-09-01

    Glycosyltransferases (GTs), an essential class of ubiquitous enzymes, are generally perceived as unidirectional catalysts. In contrast, we report that four glycosyltransferases from two distinct natural product biosynthetic pathways-calicheamicin and vancomycin-readily catalyze reversible reactions, allowing sugars and aglycons to be exchanged with ease. As proof of the broader applicability of these new reactions, more than 70 differentially glycosylated calicheamicin and vancomycin variants are reported. This study suggests the reversibility of GT-catalyzed reactions may be general and useful for generating exotic nucleotide sugars, establishing in vitro GT activity in complex systems, and enhancing natural product diversity. PMID:16946071

  13. Chemical Characterization and Reactivity of Fuel-Oxidizer Reaction Product

    NASA Technical Reports Server (NTRS)

    David, Dennis D.; Dee, Louis A.; Beeson, Harold D.

    1997-01-01

    Fuel-oxidizer reaction product (FORP), the product of incomplete reaction of monomethylhydrazine and nitrogen tetroxide propellants prepared under laboratory conditions and from firings of Shuttle Reaction Control System thrusters, has been characterized by chemical and thermal analysis. The composition of FORP is variable but falls within a limited range of compositions that depend on three factors: the fuel-oxidizer ratio at the time of formation; whether the composition of the post-formation atmosphere is reducing or oxidizing; and the reaction or post-reaction temperature. A typical composition contains methylhydrazinium nitrate, ammonium nitrate, methylammonium nitrate, and trace amounts of hydrazinium nitrate and 1,1-dimethylhydrazinium nitrate. Thermal decomposition reactions of the FORP compositions used in this study were unremarkable. Neither the various compositions of FORP, the pure major components of FORP, nor mixtures of FORP with propellant system corrosion products showed any unusual thermal activity when decomposed under laboratory conditions. Off-limit thruster operations were simulated by rapid mixing of liquid monomethylhydrazine and liquid nitrogen tetroxide in a confined space. These tests demonstrated that monomethylhydrazine, methylhydrazinium nitrate, ammonium nitrate, or Inconel corrosion products can induce a mixture of monomethylhydrazine and nitrogen tetroxide to produce component-damaging energies. Damaging events required FORP or metal salts to be present at the initial mixing of monomethylhydrazine and nitrogen tetroxide.

  14. Kinetics, mechanisms and products of reactions of Criegee intermediates

    NASA Astrophysics Data System (ADS)

    Orr-Ewing, Andrew

    The atmospheric ozonolysis of alkenes such as isoprene produces Criegee intermediates which are increasingly recognized as important contributors to oxidation chemistry in the Earth's troposphere. Stabilized Criegee intermediates are conveniently produced in the laboratory by ultraviolet photolysis of diiodoalkanes in the presence of O2, and can be detected by absorption spectroscopy using their strong electronic bands in the near ultraviolet region. We have used these techniques to study a wide range of reactions of Criegee intermediates, including their self-reactions, and reactions with carboxylic acids and various other trace atmospheric constituents. In collaboration with the Sandia National Laboratory group led by Drs C.A. Taatjes and D.L. Osborn, we have used photoionization and mass spectrometry methods, combined with electronic structure calculations, to characterize the products of several of these reactions. Our laboratory studies determine rate coefficients for the Criegee intermediate reactions, many of which prove to be fast. In the case of reactions with carboxylic acids, a correlation between the dipole moments of the reactants and the reaction rate coefficients suggests a dipole-capture controlled reaction and allows us to propose a structure-activity relationship to predict the rates of related processes. The contributions of these various Criegee intermediate reactions to the chemistry of the troposphere have been assessed using the STOCHEM-CRI global atmospheric chemistry model. This work was supported by NERC grant NE/K004905/1.

  15. Regulation of histone H3K4 methylation in brain development and disease.

    PubMed

    Shen, Erica; Shulha, Hennady; Weng, Zhiping; Akbarian, Schahram

    2014-09-26

    The growing list of mutations implicated in monogenic disorders of the developing brain includes at least seven genes (ARX, CUL4B, KDM5A, KDM5C, KMT2A, KMT2C, KMT2D) with loss-of-function mutations affecting proper regulation of histone H3 lysine 4 methylation, a chromatin mark which on a genome-wide scale is broadly associated with active gene expression, with its mono-, di- and trimethylated forms differentially enriched at promoter and enhancer and other regulatory sequences. In addition to these rare genetic syndromes, dysregulated H3K4 methylation could also play a role in the pathophysiology of some cases diagnosed with autism or schizophrenia, two conditions which on a genome-wide scale are associated with H3K4 methylation changes at hundreds of loci in a subject-specific manner. Importantly, the reported alterations for some of the diseased brain specimens included a widespread broadening of H3K4 methylation profiles at gene promoters, a process that could be regulated by the UpSET(KMT2E/MLL5)-histone deacetylase complex. Furthermore, preclinical studies identified maternal immune activation, parental care and monoaminergic drugs as environmental determinants for brain-specific H3K4 methylation. These novel insights into the epigenetic risk architectures of neurodevelopmental disease will be highly relevant for efforts aimed at improved prevention and treatment of autism and psychosis spectrum disorders. PMID:25135975

  16. Understanding the aqueous phase ozonolysis of isoprene: distinct product distribution and mechanism from the gas phase reaction

    NASA Astrophysics Data System (ADS)

    Wang, H. L.; Huang, D.; Zhang, X.; Zhao, Y.; Chen, Z. M.

    2012-08-01

    The aqueous phase reaction of volatile organic compounds (VOCs) has not been considered in most analyses of atmospheric chemical processes. However, some experimental evidence has shown that, compared to the corresponding gas phase reaction, the aqueous chemical processes of VOCs in the bulk solutions and surfaces of ambient wet particles (cloud, fog, and wet aerosols) may potentially contribute to the products and formation of secondary organic aerosol (SOA). In the present study, we performed a laboratory experiment of the aqueous ozonolysis of isoprene at different pHs (3-7) and temperatures (4-25 °C). We detected three important kinds of products, including carbonyl compounds, peroxide compounds, and organic acids. Our results showed that the molar yields of these products were nearly independent of the investigated pHs and temperatures, those were (1) carbonyls: 56.7 ± 3.7 % formaldehyde, 42.8 ± 2.5 % methacrolein (MAC), and 57.7 ± 3.4 % methyl vinyl ketone (MVK); (2) peroxides: 53.4 ± 4.1 % hydrogen peroxide (H2O2) and 15.1 ± 3.1 % hydroxylmethyl hydroperoxide (HMHP); and (3) organic acids: undetectable (<1 % estimated by the detection limit). Based on the amounts of products formed and the isoprene consumed, the total carbon yield was estimated to be 94.8 ± 4.1 %. This implied that most of the products in the reaction system were detected. The combined yields of both MAC + MVK and H2O2 + HMHP in the aqueous isoprene ozonolysis were much higher than those observed in the corresponding gas phase reaction. We suggest that these unexpected high yields of carbonyls and peroxides are related to the greater capability of condensed water, compared to water vapor, to stabilize energy-rich Criegee radicals. This aqueous ozonolysis of isoprene (and possibly other biogenic VOCs) could potentially occur on the surfaces of ambient wet particles and plants. Moreover, the high-yield carbonyl and peroxide products might provide a considerable source of aqueous phase

  17. Acid-catalyzed reactions of hexanal on sulfuric acid particles: Identification of reaction products

    NASA Astrophysics Data System (ADS)

    Garland, Rebecca M.; Elrod, Matthew J.; Kincaid, Kristi; Beaver, Melinda R.; Jimenez, Jose L.; Tolbert, Margaret A.

    While it is well established that organics compose a large fraction of the atmospheric aerosol mass, the mechanisms through which organics are incorporated into atmospheric aerosols are not well understood. Acid-catalyzed reactions of compounds with carbonyl groups have recently been suggested as important pathways for transfer of volatile organics into acidic aerosols. In the present study, we use the aerodyne aerosol mass spectrometer (AMS) to probe the uptake of gas-phase hexanal into ammonium sulfate and sulfuric acid aerosols. While both deliquesced and dry non-acidic ammonium sulfate aerosols showed no organic uptake, the acidic aerosols took up substantial amounts of organic material when exposed to hexanal vapor. Further, we used 1H-NMR, Fourier transform infrared (FTIR) spectroscopy and GC-MS to identify the products of the acid-catalyzed reaction of hexanal in acidic aerosols. Both aldol condensation and hemiacetal products were identified, with the dominant reaction products dependent upon the initial acid concentration of the aerosol. The aldol condensation product was formed only at initial concentrations of 75-96 wt% sulfuric acid in water. The hemiacetal was produced at all sulfuric acid concentrations studied, 30-96 wt% sulfuric acid in water. Aerosols up to 88.4 wt% organic/11.1 wt% H 2SO 4/0.5 wt% water were produced via these two dimerization reaction pathways. The UV-VIS spectrum of the isolated aldol condensation product, 2-butyl 2-octenal, extends into the visible region, suggesting these reactions may impact aerosol optical properties as well as aerosol composition. In contrast to previous suggestions, no polymerization of hexanal or its products was observed at any sulfuric acid concentration studied, from 30 to 96 wt% in water.

  18. Synthesis of superheavy nuclei: A search for new production reactions

    SciTech Connect

    Zagrebaev, Valery; Greiner, Walter

    2008-09-15

    Nuclear reactions leading to the formation of new superheavy (SH) elements and isotopes are discussed in the paper. 'Cold' and 'hot' synthesis, fusion of fission fragments, transfer reactions, and reactions with radioactive ion beams are analyzed along with their abilities and limitations. If the possibility of increasing the beam intensity and the detection efficiency (by a total of one order of magnitude) is found, then several isotopes of new elements with Z=120-124 could be synthesized in fusion reactions of titanium, chromium, and iron beams with actinide targets. The use of light- and medium-mass neutron-rich radioactive beams may help us fill the gap between the SH nuclei produced in the hot fusion reactions and the mainland. In these reactions, we may really approach the 'island of stability.' Such a possibility is also provided by the multinucleon transfer processes in low-energy damped collisions of heavy actinide nuclei. The production of SH elements in fusion reactions with accelerated fission fragments looks less encouraging.

  19. Prototropic tautomerism of 4-Methyl 1,2,4-Triazole-3-Thione molecule in solvent water medium: DFT and Car-Parrinello molecular dynamics study

    NASA Astrophysics Data System (ADS)

    Dutta, Bipan; De, Rina; Chowdhury, Joydeep

    2015-12-01

    The ground state prototropic tautomerism of 4-Methyl 1,2,4-Triazole-3-Thione molecule in solvent water medium has been investigated with the aid of DFT and Car-Parrinello molecular dynamics (CPMD) simulation studies. The CPMD simulations envisage the possibility of proton transfer reactions of the molecule through the solvent water medium. Probable proton transfer pathways have been predicted from the DFT calculations which are substantiated by the natural bond orbital analyses. The evolution and breaking of the concerned bonds of the molecule for different proton transfer reaction pathways are also estimated.

  20. Fission-product SiC reaction in HTGR fuel

    SciTech Connect

    Montgomery, F.

    1981-07-13

    The primary barrier to release of fission product from any of the fuel types into the primary circuit of the HTGR are the coatings on the fuel particles. Both pyrolytic carbon and silicon carbide coatings are very effective in retaining fission gases under normal operating conditions. One of the possible performance limitations which has been observed in irradiation tests of TRISO fuel is chemical interaction of the SiC layer with fission products. This reaction reduces the thickness of the SiC layer in TRISO particles and can lead to release of fission products from the particles if the SiC layer is completely penetrated. The experimental section of this report describes the results of work at General Atomic concerning the reaction of fission products with silicon carbide. The discussion section describes data obtained by various laboratories and includes (1) a description of the fission products which have been found to react with SiC; (2) a description of the kinetics of silicon carbide thinning caused by fission product reaction during out-of-pile thermal gradient heating and the application of these kinetics to in-pile irradiation; and (3) a comparison of silicon carbide thinning in LEU and HEU fuels.

  1. Energy distribution among reaction products. VII - H + F2.

    NASA Technical Reports Server (NTRS)

    Polanyi, J. C.; Sloan, J. J.

    1972-01-01

    The 'arrested relaxation' variant of the IR chemiluminescence technique is used in a study of the distribution of vibrational, rotational and translational energies between the products of the reaction by which H + F2 yields HF + F. Diagrams are plotted and numerical values are obtained for the energy distribution rate constants.

  2. CHLORINE DIOXIDE CHEMISTRY, REACTIONS, AND DISINFECTION BY-PRODUCTS

    EPA Science Inventory

    This chapter contains two main sections-the first section describes the chemistry and reactions of chlorine dioxide, and the second describes the disinfection by-products (DBPs) of chlorine dioxide and their control. A short section on Research Needs completes this chapter. The...

  3. Clocking Surface Reaction by In-Plane Product Rotation.

    PubMed

    Anggara, Kelvin; Huang, Kai; Leung, Lydie; Chatterjee, Avisek; Cheng, Fang; Polanyi, John C

    2016-06-15

    Electron-induced reaction of physisorbed meta-diiodobenzene (mDIB) on Cu(110) at 4.6 K was studied by Scanning Tunneling Microscopy and molecular dynamics theory. Single-electron dissociation of the first C-I bond led to in-plane rotation of an iodophenyl (IPh) intermediate, whose motion could be treated as a "clock" of the reaction dynamics. Alternative reaction mechanisms, successive and concerted, were observed giving different product distributions. In the successive mechanism, two electrons successively broke single C-I bonds; the first C-I bond breaking yielded IPh that rotated directionally by three different angles, with the second C-I bond breaking giving chemisorbed I atoms (#2) at three preferred locations corresponding to the C-I bond alignments in the prior rotated IPh configurations. In the concerted mechanism a single electron broke two C-I bonds, giving two chemisorbed I atoms; significantly these were found at angles corresponding to the C-I bond direction for unrotated mDIB. Molecular dynamics accounted for the difference in reaction outcomes between the successive and the concerted mechanisms in terms of the time required for the IPh to rotate in-plane; in successive reaction the time delay between first and second C-I bond-breaking events allowed the IPh to rotate, whereas in concerted reaction the computed delay between excitation and reaction (∼1 ps) was too short for molecular rotation before the second C-I bond broke. The dependence of the extent of motion at a surface on the delay between first and second bond breaking suggested a novel means to "clock" sub-picosecond dynamics by imaging the products arising from varying time delays between impacting pairs of electrons. PMID:27191189

  4. Metabolic transit and toxicity of Maillard reaction products.

    PubMed

    Finot, P A; Furniss, D E

    1989-01-01

    The feeding of Maillard reaction products (MRP) has been reported to lead to a variety of effects on metabolism which may be classed as "anti-nutritional" or "anti-physiological", depending on whether they are due to the loss of essential nutrients or to the presence of the MRP per se. This paper describes the sensitivity of essential nutrients in the "early" and "advanced" stages of the Maillard reaction, the metabolic transit of Amadori compounds, premelanoidins, melanoidins, hydroxymethyl-furfural, carboxymethyl-lysine, as well as the effects of MRP on pancreatic amylase and on urinary zinc excretion. PMID:2506565

  5. Sorption enhanced reaction process (SERP) for production of hydrogen

    SciTech Connect

    Sircar, S.; Anand, M.; Carvill, B.

    1995-09-01

    Sorption Enhanced Reaction (SER) is a novel process that is being developed for the production of lower cost hydrogen by steam-methane reforming (SMR). In this process, the reaction of methane with steam is carried out in the presence of an admixture of a catalyst and a selective adsorbent for carbon dioxide. The consequences of SER are: (1) reformation reaction at a significantly lower temperature (300-500{degrees}C) than conventional SMR (800-1100{degrees}C), while achieving the same conversion of methane to hydrogen, (2) the product hydrogen is obtained at reactor pressure (200-400 psig) and at 99+% purity directly from the reactor (compared to only 70-75% H{sub 2} from conventional SMR reactor), (3) downstream hydrogen purification step is either eliminated or significantly reduced in size. The early focus of the program will be on the identification of an adsorbent/chemisorbent for CO{sub 2} and on the demonstration of the SER concept for SMR in our state-of-the-art bench scale process. In the latter stages, a pilot plant will be built to scale-up the technology and to develop engineering data. The program has just been initiated and no significant results for SMR will be reported. However, results demonstrating the basic principles and process schemes of SER technology will be presented for reverse water gas shift reaction as the model reaction. If successful, this technology will be commercialized by Air Products and Chemicals, Inc. (APCI) and used in its existing hydrogen business. APCI is the world leader in merchant hydrogen production for a wide range of industrial applications.

  6. Maillard reaction products from chitosan-xylan ionic liquid solution.

    PubMed

    Luo, Yuqiong; Ling, Yunzhi; Wang, Xiaoying; Han, Yang; Zeng, Xianjie; Sun, Runcang

    2013-10-15

    A facile method is reported to prepare Maillard reaction products (MRPs) from chitosan and xylan in co-solvent ionic liquid. UV absorbance and fluorescence changes were regarded as indicators of the occurrence of Maillard reaction. FT-IR, NMR, XRD and TG were used to investigate the structure of chitosan-xylan conjugate. The results revealed that when chitosan reacted with xylan in ionic liquid, the hydrogen bonds in chitosan were destroyed, the facts resulted in the formation of chitosan-xylan MRPs. Moreover, when the mass ratio of chitosan to xylan was 1:1, the Maillard reaction proceeded easily. In addition, relatively high antioxidant property was also noted for the chitosan-xylan conjugate with mass ratio 1:1. So the obtained chitosan-xylan MRP is a promising antioxidant agent for food industry. PMID:23987419

  7. Reaction behavior of zircaloy with simulated fission products

    SciTech Connect

    Kohli, R.

    1981-01-01

    The investigation reported in this paper was prompted by the lack of information on the reaction behavior of Zircaloy on long-term exposure to fission product environments in the temperature range 573 - 973 K. Small Zircaloy-2 (Zircaloy-2 contains by weight 1.5% Sn; 0.15% Fe; 0.08% Cr; 0.05% Ni; rest Zr) strip specimens (ca. 25mm x 3mm x 0.75 mm thick) were exposed to various simulated fission product environments (Cs, I, Br, Cd, In, Sb, Sn, Se as vapor; all others as powders) for times to 5.4 Ms (1500 h) in the temperature range 673 - 973 K. The reaction behavior was characterized by scanning electron microscopy with an EDAX analyzer, optical metallography, and x-ray diffraction.

  8. Dual Position Sensitive MWPC for tracking reaction products at VAMOS++

    NASA Astrophysics Data System (ADS)

    Vandebrouck, M.; Lemasson, A.; Rejmund, M.; Fremont, G.; Pancin, J.; Navin, A.; Michelagnoli, C.; Goupil, J.; Spitaels, C.; Jacquot, B.

    2016-03-01

    The characteristics and performance of a Dual Position Sensitive Multi-Wire Proportional Counter (DPS-MWPC) used to measure the scattering angle, the interaction position on the target and the velocity of reaction products detected in the VAMOS++ magnetic spectrometer, are reported. The detector consists of a pair of position sensitive low pressure MWPCs and provides both fast timing signals, along with the two-dimensional position coordinates required to define the trajectory of the reaction products. A time-of-flight resolution of 305(11) ps (FWHM) was measured. The measured resolutions (FWHM) were 2.5(3) mrad and 560(70) μm for the scattering angle and the interaction point at the target respectively. The subsequent improvement of the Doppler correction of the energy of the γ-rays, detected in the γ-ray tracking array AGATA in coincidence with isotopically identified ions in VAMOS++, is also discussed.

  9. Evaluation of photon production data from neutron-induced reactions

    SciTech Connect

    Fu, C.Y.

    1980-01-01

    The evaluation methods and procedures used for generating the photon production data in the current Evaluated Nuclear Data File (ENDF/B, Version V) are reviewed. There are 42 materials in the General Purpose File of ENDF/B-V that contain data for prompt photon production. Almost all evaluations had substantial experimental data bases, but fewer than half of them employed any of the following evaluation methods. Only a few used theoretical techniques that are sophisticated enough to ensure internal consistency with other particle production data. Comments are made on four evaluation methods: the empirical formalism of Howerton et al., the Troubetzkoy model, the multiparticle Hauser-Feshbach/precompound model, and the Yost method. Critiques are also made on three procedures used for conserving photon energies in neutron capture reactions. The presence of photon production data in the file is useful for studying energy balance, since photon production generally accounts for a large portion of the reaction energy output. Problems found in energy balance checks are discussed. 9 figures, 1 table.

  10. Bis[4-(dimethyl-amino)pyridinium] tetra-bromidobis(4-methyl-phen-yl)stannate(IV).

    PubMed

    Lee, See Mun; Lo, Kong Mun; Mohd Ali, Hapipah; Robinson, Ward T

    2009-01-01

    In the title compound, (C(7)H(11)N(2))(2)[SnBr(4)(C(7)H(7))(2)], the tetra-bromidobis(4-methyl-phen-yl)stannate(IV) anion possesses a centre of inversion located at the Sn(IV) atom. In the crystal structure, two inversion-related cations are linked to the anion via weak N-H⋯Br hydrogen bonds. PMID:21577403

  11. A study of switchgrass pyrolysis: Product variability and reaction kinetics

    NASA Astrophysics Data System (ADS)

    Bovee, Jonathan Matthew

    Samples of the same cultivar of cave-in-rock switchgrass were harvested from plots in Frankenmuth, Roger City, Cass County, and Grand Valley, Michigan. It was determined that variation exists, between locations, among the pyrolytic compounds which can lead to variability in bio-oil and increased processing costs at bio-refineries to make hydrocarbon fuels. Washed and extractives-free switchgrass samples, which contain a lower alkali and alkaline earth metals content than untreated samples, were shown to produce lower amounts of acids, esters, furans, ketones, phenolics, and saccharides and also larger amounts of aldehydes upon pyrolysis. Although the minerals catalyzed pyrolytic reactions, there was no evidence indicating their effect on reducing the production of anhydrosugars, specifically levoglucosan. To further link minerals present in the biomass to a catalytic pathway, mathematic models were employed to determine the kinetic parameters of the switchgrass. While the calculated activation energies of switchgrass, using the FWO and KAS methods, were 227.7 and 217.8 kJ/mol, correspondingly, it was concluded that the activation energies for the switchgrass hemicellulose and cellulose peaks were 115.5 and 158.2 kJ/mol, respectively, using a modified model-fitting method. The minerals that effect the production of small molecules and levoglucosan also have an observable catalytic effect on switchgrass reaction rate, which may be quantifiable through the use of reaction kinetics so as to determine activation energy.

  12. Human hepatic metabolism of the anti-osteoporosis drug eldecalcitol involves sterol C4-methyl oxidase

    PubMed Central

    Yasuda, Kaori; Iwanaga, Yuasa; Ogawa, Kazuaki; Mano, Hiroki; Ueno, Sera; Kimoto, Shutaro; Ohta, Miho; Kamakura, Masaki; Ikushiro, Shinichi; Sakaki, Toshiyuki

    2015-01-01

    The metabolism of eldecalcitol (ED-71), a 2β-hydroxypropoxylated analog of the active form of vitamin D3 was investigated by using in vitro systems. ED-71 was metabolized to 1α,2β,25-trihydroxyvitamin D3 (1α,2β,25(OH)3D3) in human small intestine and liver microsomes. To identify the enzymes involved in this metabolism, we examined NADPH-dependent metabolism by recombinant P450 isoforms belonging to the CYP1, 2, and 3 families, and revealed that CYP3A4 had the activity. However, the CYP3A4 -specific inhibitor, ketoconazole, decreased the activity in human liver microsomes by only 36%, suggesting that other enzymes could be involved in ED-71 metabolism. Because metabolism was dramatically inhibited by cyanide, we assumed that sterol C4-methyl oxidase like gene product (SC4MOL) might contribute to the metabolism of ED-71. It is noted that SC4MOL is physiologically essential for cholesterol synthesis. Recombinant human SC4MOL expressed in COS7, Saccharomyces cerevisiae, or Escherichia coli cells converted ED-71 to 1α,2β,25(OH)3D3. Furthermore, we evaluated the metabolism of ED-71 by recombinant CYP24A1, which plays an important role in the metabolism of the active form of vitamin D3 (1α,25(OH)2D3) and its analogs. The kcat/Km value for 24- or 23-hydroxylation of ED-71 was only 3% of that for 1α,25(OH)2D3, indicating that ED-71 was resistant to CYP24A1-dependent catabolism. Among the three enzymes catalyzing ED-71, SC4MOL appears to be most important in the metabolism of ED-71. To the best of our knowledge, this is the first study showing that SC4MOL can function as a drug-metabolizing enzyme. The yeast and E. coli expression systems for SC4MOL could be useful for structure-function analyses of SC4MOL. PMID:26038696

  13. Manifestation of macroscopic correlations in elementary reaction kinetics. I. Irreversible reaction A+A-->product.

    PubMed

    Doktorov, Alexander B; Kipriyanov, Alexander A; Kipriyanov, Alexey A

    2010-05-28

    Using an modern many-particle method for the derivation of non-Markovian binary kinetic equations, we have treated theoretically the applicability of the encounter theory (ET) (the prototype of the collision theory) concepts to the widely known diffusion assisted irreversible bulk reaction A+A-->product (for example, radical reaction) in dilute solutions. The method shows that the agreement with the ET is observed when the familiar integral ET is employed which in this method is just a step in the derivation of kinetic equations. It allows for two-particle correlations only, but fails to take account of correlation of reactant simultaneously with the partner of the encounter and the reactant in the bulk. However, the next step leading to the modified ET under transformation of equations to the regular form both extends the time range of the applicability of ET rate equation (as it was for reactions proceeding with one of the reactants in excess), and gives the equation of the generalized ET. In full agreement with physical considerations, this theory reveals macroscopic correlations induced by the encounters in the reservoir of free walks. This means that the encounters of reactants in solution are correlated on a rather large time interval of the reaction. Though any nonstationary (non-Markovian) effects manifest themselves rather weakly in the kinetics of the bimolecular reaction in question, just the existence of the revealed macroscopic correlations in the binary theory is of primary importance. In particular, it means that the well-known phenomena which are generally considered to be associated solely with correlation of particles on the encounter (for example, chemically induced dynamic nuclear polarization) may be induced by correlation in the reservoir of free random walks of radicals in solution. PMID:20515095

  14. Theoretical aspects of product formation from the NCO + NO reaction

    SciTech Connect

    Lin, M.C.; He, Y. ); Melius, C.F. )

    1993-09-09

    The reaction of NCO with NO, an important elementary process involved in the reduction of NO[sub x] by HNCO, has been studied theoretically using the BAC-MP4 technique in conjunction with RRKM calculations. The computed molecular structures and thermochemical data for various intermediates and transition states suggest that the reaction takes place primarily via the singlet, ground electronic state OCNNO molecule according to the following mechanism; (step a) NCO + NO [leftrightarrow] [sup 1]OCNNO [yields] N[sub 2]O + CO; (step b) NCO + NO [leftrightarrow] [sup 1]OCNNO [yields] c-OCNNO[minus] N[sub 2] + CO[sub 2]. The formation of N[sub 2]O + CO occurs by the fragmentation of the singlet OCNNO intermediate step (a), whereas the production of N[sub 2] + CO[sub 2] by cyclization-fragmentation occurs via step b. The tight transition states leading to the formation of these products, coupled with the loose entrance channel, give rise to the experimentally observed strong negative temperature dependence which can be quantitatively accounted for by the results of RRKM calculations based on the BAC-MP4 data. The experimentally measured product branching ratio for channels a and b could be accounted for theoretically by lowering the calculated energy barrier for step a by 3.6 kcal/mol, corresponding to about 15% of the barrier height. 22 refs., 3 figs., 5 tabs.

  15. Production of Energetic Light Fragments in Spallation Reactions

    NASA Astrophysics Data System (ADS)

    Mashnik, Stepan G.; Kerby, Leslie M.; Gudima, Konstantin K.; Sierk, Arnold J.

    2014-03-01

    Different reaction mechanisms contribute to the production of light fragments (LF) from nuclear reactions. Available models cannot accurately predict emission of LF from arbitrary reactions. However, the emission of LF is important formany applications, such as cosmic-ray-induced single event upsets, radiation protection, and cancer therapy with proton and heavy-ion beams, to name just a few. The cascade-exciton model (CEM) and the Los Alamos version of the quark-gluon string model (LAQGSM), as implemented in the CEM03.03 and LAQGSM03.03 event generators used in the Los Alamos Monte Carlo transport code MCNP6, describe quite well the spectra of fragments with sizes up to 4He across a broad range of target masses and incident energies. However, they do not predict high-energy tails for LF heavier than 4He. The standard versions of CEM and LAQGSM do not account for preequilibrium emission of LF larger than 4He. The aim of our work is to extend the preequilibrium model to include such processes. We do this by including the emission of fragments heavier than 4He at the preequilibrium stage, and using an improved version of the Fermi Break-up model, providing improved agreement with various experimental data.

  16. Reactions of superoxide with myeloperoxidase and its products.

    PubMed

    Winterbourn, Christine C; Kettle, Anthony J

    2004-10-01

    Myeloperoxidase (MPO) uses hydrogen peroxide to oxidize chloride to hypochlorous acid. It also converts numerous substrates to reactive free radicals. When released by neutrophils, the enzyme operates in the presence of a flux of superoxide. We show that superoxide has a profound influence on oxidative reactions catalysed by MPO. It reacts directly with the enzyme to modulate production of hypochlorous acid. Within neutrophil phagosomes, where MPO functions to kill micro-organisms, it may be the preferred substrate for the enzyme. Superoxide also reacts rapidly with radicals generated by MPO, e.g. from tyrosine and tyrosyl peptides. Initial products are organic peroxides. These species are likely to be toxic and contribute to the pathophysiological actions of MPO. PMID:15507767

  17. Removal of triclosan via peroxidases-mediated reactions in water: Reaction kinetics, products and detoxification.

    PubMed

    Li, Jianhua; Peng, Jianbiao; Zhang, Ya; Ji, Yuefei; Shi, Huanhuan; Mao, Liang; Gao, Shixiang

    2016-06-01

    This study investigated and compared reaction kinetics, product characterization, and toxicity variation of triclosan (TCS) removal mediated by soybean peroxidase (SBP), a recognized potential peroxidase for removing phenolic pollutants, and the commonly used horseradish peroxidase (HRP) with the goal of assessing the technical feasibility of SBP-catalyzed removal of TCS. Reaction conditions such as pH, H2O2 concentration and enzyme dosage were found to have a strong influence on the removal efficiency of TCS. SBP can retain its catalytic ability to remove TCS over broad ranges of pH and H2O2 concentration, while the optimal pH and H2O2 concentration were 7.0 and 8μM, respectively. 98% TCS was removed with only 0.1UmL(-1) SBP in 30min reaction time, while an HRP dose of 0.3UmL(-1) was required to achieve the similar conversion. The catalytic performance of SBP towards TCS was more efficient than that of HRP, which can be explained by catalytic rate constant (KCAT) and catalytic efficiency (KCAT/KM) for the two enzymes. MS analysis in combination with quantum chemistry computation showed that the polymerization products were generated via CC and CO coupling pathways. The polymers were proved to be nontoxic through growth inhibition of green alga (Scenedesmus obliquus). Taking into consideration of the enzymatic treatment cost, SBP may be a better alternative to HRP upon the removal and detoxification of TCS in water/wastewater treatment. PMID:26921508

  18. 40 CFR 721.10154 - Quaternary ammonium compounds, dicoco alkyldimethyl, chlorides, reaction products with silica.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ..., dicoco alkyldimethyl, chlorides, reaction products with silica. (a) Chemical substance and significant... alkyldimethyl, chlorides, reaction products with silica. 721.10154 Section 721.10154 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  19. 40 CFR 721.10154 - Quaternary ammonium compounds, dicoco alkyldimethyl, chlorides, reaction products with silica.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ..., dicoco alkyldimethyl, chlorides, reaction products with silica. (a) Chemical substance and significant... alkyldimethyl, chlorides, reaction products with silica. 721.10154 Section 721.10154 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  20. 40 CFR 721.10126 - Alkyl amino substituted triazine amino substituted benezenesulfonic acid reaction product with...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... substituted benezenesulfonic acid reaction product with naphthalenesulfonato azo substituted phenyl azo... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10126 Alkyl amino substituted triazine amino substituted benezenesulfonic acid reaction product with naphthalenesulfonato...

  1. 40 CFR 721.10154 - Quaternary ammonium compounds, dicoco alkyldimethyl, chlorides, reaction products with silica.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ..., dicoco alkyldimethyl, chlorides, reaction products with silica. (a) Chemical substance and significant... alkyldimethyl, chlorides, reaction products with silica. 721.10154 Section 721.10154 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  2. 40 CFR 721.10154 - Quaternary ammonium compounds, dicoco alkyldimethyl, chlorides, reaction products with silica.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ..., dicoco alkyldimethyl, chlorides, reaction products with silica. (a) Chemical substance and significant... alkyldimethyl, chlorides, reaction products with silica. 721.10154 Section 721.10154 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  3. 40 CFR 721.10126 - Alkyl amino substituted triazine amino substituted benezenesulfonic acid reaction product with...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... substituted benezenesulfonic acid reaction product with naphthalenesulfonato azo substituted phenyl azo... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10126 Alkyl amino substituted triazine amino substituted benezenesulfonic acid reaction product with naphthalenesulfonato...

  4. 40 CFR 721.10154 - Quaternary ammonium compounds, dicoco alkyldimethyl, chlorides, reaction products with silica.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ..., dicoco alkyldimethyl, chlorides, reaction products with silica. (a) Chemical substance and significant... alkyldimethyl, chlorides, reaction products with silica. 721.10154 Section 721.10154 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  5. Water-soluble reaction products from ozonolysis of grasses

    SciTech Connect

    Morrison, W.H. III; Akin, D.E. )

    1990-03-01

    Ozone has been used to pretreat agricultural byproducts with the aim of increasing nutritive value for ruminants. However, not all treatments with ozone result in enhanced digestibility, suggesting reaction products from ozone treatment of plants might inhibit rumen microbial activity. Coastal Bermuda grass (Cynodon dactylon L. Pers.) (CBG) and Kentucky-31 tall fescue (Festuca arundinacea Schreb.) (K-31) were treated with ozone and the water-soluble products determined. The following acids were identified: caproic, levulinic, p-hydroxybenzoic, vinillic, azelaic, and malonic. In addition, vanillin and p-hydroxybenzaldehyde were also identified. Ozone treatment of the cell walls of CBG produced mainly p-hydroxybenzoic acid, vanillic acid, azelaic acid, p-hydroxybenzaldehyde, and vanillin. Ozone treatment of K-31 cell walls produced levulinic acid in addition to those products found from CBG cell walls. The production of vanillin and p-hydroxybenzaldehyde, which have been shown to be especially toxic to rumen microorganisms, offers an explanation for the negative affects of ozone treatment on forage.

  6. Reaction products in mass spectrometry elucidated with infrared spectroscopy.

    PubMed

    Polfer, Nick C; Oomens, Jos

    2007-08-01

    Determining the structure and dynamics of large biologically relevant molecules is one of the key challenges facing biology. Although X-ray crystallography (XRD) and nuclear magnetic resonance (NMR) yield accurate structural information, they are of limited use when sample quantities are low. Mass spectrometry (MS) on the other hand has been very successful in analyzing biological molecules down to atto-mole quantities and has hence begun to challenge XRD and NMR as the key technology in the life sciences. This trend has been further assisted by the development of MS techniques that yield structural information on biomolecules. Of these techniques, collision-induced dissociation (CID) and hydrogen/deuterium exchange (HDX) are among the most popular. Despite advances in applying these techniques, little direct experimental evidence had been available until recently to verify their proposed underlying reaction mechanisms. The possibility to record infrared spectra of mass-selected molecular ions has opened up a novel avenue in the structural characterization of ions and their reaction products. On account of its high pulse energies and wide wavelength tunability, the free electron laser for infrared experiments (FELIX) at FOM Rijnhuizen has been shown to be ideally suited to study trapped molecular ions with infrared photo-dissociation spectroscopy. In this paper, we review recent experiments in our laboratory on the infrared spectroscopic characterization of reaction products from CID and HDX, thereby corroborating some of the reaction mechanisms that have been proposed. In particular, it is shown that CID gives rise to linear fragment ion structures which have been proposed for some time, but also yields fully cyclical ring structures. These latter structures present a possible challenge for using tandem MS in the sequencing of peptides/proteins, as they can lead to a scrambling of the amino acid sequence information. In gas-phase HDX of an amino acid it is shown

  7. 40 CFR 721.10390 - Acetoacetanilide reaction product with multifunctional acrylate (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... New Uses for Specific Chemical Substances § 721.10390 Acetoacetanilide reaction product with... chemical substance identified generically as acetoacetanilide reaction product with multifunctional... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Acetoacetanilide reaction product...

  8. 40 CFR 721.9514 - Ethyl silicate, reaction products with modified alkoxysilane salt (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.9514 Ethyl silicate, reaction products with.... (1) The chemical substance identified generically as Ethyl silicate, reaction products with modified... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Ethyl silicate, reaction products...

  9. 40 CFR 721.10570 - Cyclic amine reaction product with acetophenone and formaldehyde acid salt (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10570 Cyclic amine reaction product... subject to reporting. (1) The chemical substance identified generically as cyclic amine reaction product... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Cyclic amine reaction product...

  10. 40 CFR 721.9485 - Dimer acid/polymerized rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... reaction product (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as Dimer acid/polymerized rosin amidoamine reaction product (PMN... amidoamine reaction product (generic). 721.9485 Section 721.9485 Protection of Environment...

  11. 40 CFR 721.10445 - 2-Propen-1-ol, reaction products with hydrogen sulfide, distn. residues.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10445 2-Propen-1-ol, reaction products with...) The chemical substance identified as 2-propen-1-ol, reaction products with hydrogen sulfide, distn... 40 Protection of Environment 32 2013-07-01 2013-07-01 false 2-Propen-1-ol, reaction products...

  12. 40 CFR 721.10428 - Fatty acids, C18-unsatd., dimers, reaction products with 1-piperazineethanamine.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ..., reaction products with 1-piperazineethanamine. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as fatty acids, C18-unsatd., dimers, reaction products with..., reaction products with 1-piperazineethanamine. 721.10428 Section 721.10428 Protection of...

  13. 40 CFR 721.10390 - Acetoacetanilide reaction product with multifunctional acrylate (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... New Uses for Specific Chemical Substances § 721.10390 Acetoacetanilide reaction product with... chemical substance identified generically as acetoacetanilide reaction product with multifunctional... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Acetoacetanilide reaction product...

  14. 40 CFR 721.9514 - Ethyl silicate, reaction products with modified alkoxysilane salt (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.9514 Ethyl silicate, reaction products with.... (1) The chemical substance identified generically as Ethyl silicate, reaction products with modified... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Ethyl silicate, reaction products...

  15. 40 CFR 721.3805 - Formaldehyde, reaction products with 1,3-benzenedimethanamine and bisphenol A.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3805 Formaldehyde, reaction products... to reporting. (1) The chemical substance identified as formaldehyde, reaction products with 1,3... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Formaldehyde, reaction products with...

  16. 40 CFR 721.10570 - Cyclic amine reaction product with acetophenone and formaldehyde acid salt (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10570 Cyclic amine reaction product... subject to reporting. (1) The chemical substance identified generically as cyclic amine reaction product... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Cyclic amine reaction product...

  17. 40 CFR 721.10428 - Fatty acids, C18-unsatd., dimers, reaction products with 1-piperazineethanamine.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ..., reaction products with 1-piperazineethanamine. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as fatty acids, C18-unsatd., dimers, reaction products with..., reaction products with 1-piperazineethanamine. 721.10428 Section 721.10428 Protection of...

  18. 40 CFR 721.10445 - 2-Propen-1-ol, reaction products with hydrogen sulfide, distn. residues.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10445 2-Propen-1-ol, reaction products with...) The chemical substance identified as 2-propen-1-ol, reaction products with hydrogen sulfide, distn... 40 Protection of Environment 31 2014-07-01 2014-07-01 false 2-Propen-1-ol, reaction products...

  19. 40 CFR 721.9514 - Ethyl silicate, reaction products with modified alkoxysilane salt (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.9514 Ethyl silicate, reaction products with.... (1) The chemical substance identified generically as Ethyl silicate, reaction products with modified... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Ethyl silicate, reaction products...

  20. 40 CFR 721.9514 - Ethyl silicate, reaction products with modified alkoxysilane salt (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.9514 Ethyl silicate, reaction products with.... (1) The chemical substance identified generically as Ethyl silicate, reaction products with modified... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Ethyl silicate, reaction products...

  1. 40 CFR 721.3805 - Formaldehyde, reaction products with 1,3-benzenedimethanamine and bisphenol A.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3805 Formaldehyde, reaction products... to reporting. (1) The chemical substance identified as formaldehyde, reaction products with 1,3... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Formaldehyde, reaction products with...

  2. 40 CFR 721.9485 - Dimer acid/polymerized rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... reaction product (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as Dimer acid/polymerized rosin amidoamine reaction product (PMN... amidoamine reaction product (generic). 721.9485 Section 721.9485 Protection of Environment...

  3. 40 CFR 721.9485 - Dimer acid/polymerized rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... reaction product (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as Dimer acid/polymerized rosin amidoamine reaction product (PMN... amidoamine reaction product (generic). 721.9485 Section 721.9485 Protection of Environment...

  4. 40 CFR 721.10494 - Reaction product of trimethylolpropane triacrylate and alkylene imine (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10494 Reaction product of trimethylolpropane.... (1) The chemical substance identified generically as reaction product of trimethylolpropane... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of...

  5. 40 CFR 721.10494 - Reaction product of trimethylolpropane triacrylate and alkylene imine (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10494 Reaction product of trimethylolpropane.... (1) The chemical substance identified generically as reaction product of trimethylolpropane... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of...

  6. 40 CFR 721.3805 - Formaldehyde, reaction products with 1,3-benzenedimethanamine and bisphenol A.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3805 Formaldehyde, reaction products... to reporting. (1) The chemical substance identified as formaldehyde, reaction products with 1,3... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Formaldehyde, reaction products with...

  7. 40 CFR 721.9485 - Dimer acid/polymerized rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... reaction product (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as Dimer acid/polymerized rosin amidoamine reaction product (PMN... amidoamine reaction product (generic). 721.9485 Section 721.9485 Protection of Environment...

  8. 40 CFR 721.9285 - Reaction products of formalin (37%) with amine C12.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Specific Chemical Substances § 721.9285 Reaction products of formalin (37%) with amine C12. Link to an... to reporting. (1) The chemical substance identified generically as reaction products of formalin (37... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction products of formalin...

  9. 40 CFR 721.3805 - Formaldehyde, reaction products with 1,3-benzenedimethanamine and bisphenol A.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3805 Formaldehyde, reaction products... to reporting. (1) The chemical substance identified as formaldehyde, reaction products with 1,3... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Formaldehyde, reaction products with...

  10. 40 CFR 721.10390 - Acetoacetanilide reaction product with multifunctional acrylate (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... New Uses for Specific Chemical Substances § 721.10390 Acetoacetanilide reaction product with... chemical substance identified generically as acetoacetanilide reaction product with multifunctional... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Acetoacetanilide reaction product...

  11. 40 CFR 721.9514 - Ethyl silicate, reaction products with modified alkoxysilane salt (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.9514 Ethyl silicate, reaction products with.... (1) The chemical substance identified generically as Ethyl silicate, reaction products with modified... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Ethyl silicate, reaction products...

  12. 40 CFR 721.3805 - Formaldehyde, reaction products with 1,3-benzenedimethanamine and bisphenol A.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3805 Formaldehyde, reaction products... to reporting. (1) The chemical substance identified as formaldehyde, reaction products with 1,3... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Formaldehyde, reaction products with...

  13. 40 CFR 721.9485 - Dimer acid/polymerized rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... reaction product (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as Dimer acid/polymerized rosin amidoamine reaction product (PMN... amidoamine reaction product (generic). 721.9485 Section 721.9485 Protection of Environment...

  14. Maillard reaction products as antimicrobial components for packaging films.

    PubMed

    Hauser, Carolin; Müller, Ulla; Sauer, Tanja; Augner, Kerstin; Pischetsrieder, Monika

    2014-02-15

    Active packaging foils with incorporated antimicrobial agents release the active ingredient during food storage. Maillard reaction products (MRPs) show antimicrobial activity that is at least partially mediated by H2O2. De novo generation of H2O2 by an MRP fraction, extracted from a ribose/lysine Maillard reaction mixture by 85% ethanol, was monitored at three concentrations (1.6, 16.1, and 32.3g/L) and three temperatures (4, 25, and 37 °C) between 0 and 96 h, reaching a maximum of 335 μM H2O2 (32.3g/L, 37 °C, 96 h). The active MRP fraction (16.1g/L) completely inhibited the growth of Escherichia coli for 24h and was therefore incorporated in a polyvinyl acetate-based lacquer and dispersed onto a low-density polyethylene film. The coated film generated about 100 μM H2O2 and resulted in a log-reduction of >5 log-cycles against E. coli. Thus, MRPs can be considered as active ingredients for antimicrobial packaging materials. PMID:24128521

  15. In vivo effects of Maillard reaction products derived from biscuits.

    PubMed

    Patrignani, Mariela; Rinaldi, Gustavo Juan; Lupano, Cecilia Elena

    2016-04-01

    The antioxidant activity, antihypertensive effect and prebiotic activity of Maillard reaction products (MRPs) derived from biscuits were investigated in Wistar rats. Animals were fed the following diets for 6 weeks: control (AIN-93 diet); Asc-diet (AIN-93 diet with ascorbic acid in the drinking water); HT-B diet (containing high amount of MRP derived from biscuits) and LT-B diet (containing negligible amounts of biscuit MRP). Serum antioxidant activity (FRAP, ABTS), as well as lipid peroxidation (TBARS) were determined at the end of the experiment. Results showed that dietary MRP reduced the food efficiency, increased the antioxidant activity of serum, increased the ratio between lactic and total aerobic bacteria, increased water-holding capacity of faeces and reduced blood pressure, but did not reduce mineral absorption. Therefore, the biscuit MRP functional claims could be demonstrated by an in vivo study. PMID:26593484

  16. Sorption enhanced reaction process (SERP) for the production of hydrogen

    SciTech Connect

    Hufton, J.; Mayorga, S.; Gaffney, T.; Nataraj, S.; Rao, M.; Sircar, S.

    1998-08-01

    The novel Sorption Enhanced Reaction Process has the potential to decrease the cost of hydrogen production by steam methane reforming. Current effort for development of this technology has focused on adsorbent development, experimental process concept testing, and process development and design. A preferred CO{sub 2} adsorbent, K{sub 2}CO{sub 3} promoted hydrotalcite, satisfies all of the performance targets and it has been scaled up for process testing. A separate class of adsorbents has been identified which could potentially improve the performance of the H{sub 2}-SER process. Although this material exhibits improved CO{sub 2} adsorption capacity compared to the HTC adsorbent, its hydrothermal stability must be improved. Single-step process experiments (not cyclic) indicate that the H{sub 2}-SER reactor performance during the reaction step improves with decreasing pressure and increasing temperature and steam to methane ratio in the feed. Methane conversion in the H{sub 2}-SER reactor is higher than for a conventional catalyst-only reactor operated at similar temperature and pressure. The reactor effluent gas consists of 90+% H{sub 2}, balance CH{sub 4}, with only trace levels (< 50 ppm) of carbon oxides. A best-case process design (2.5 MMSCFD of 99.9+% H{sub 2}) based on the HTC adsorbent properties and a revised SER process cycle has been generated. Economic analysis of this design indicates the process has the potential to reduce the H{sub 2} product cost by 25--31% compared to conventional steam methane reforming.

  17. Sorption Enhanced Reaction Process (SERP) for production of hydrogen

    SciTech Connect

    Anand, M.; Hufton, J.; Mayorga, S.

    1996-10-01

    Sorption Enhanced Reaction Process (SERP) is a novel process that is being developed for the production of lower cost hydrogen by steam-methane reforming (SMR). In this process the reaction of methane with steam is carried out in the presence of an admixture of a catalyst and a selective adsorbent for carbon dioxide. The key consequences of SERP are: (i) reformation reaction is carried out at a significantly lower temperature (300-500{degrees}C) than that in a conventional SMR reactor (800-1100{degrees}C), while achieving the same conversion of methane to hydrogen, (ii) the product hydrogen is obtained at reactor pressure (200-400 psig) and at 98+% purity directly from the reactor (compared to only 70-75% H{sub 2} from conventional SMR reactor), (iii) downstream hydrogen purification step is either eliminated or significantly reduced in size. The first phase of the program has focused on the development of a sorbent for CO{sub 2} which has (a) reversible CO{sub 2} capacity >0.3 mmol/g at low partial pressures of CO{sub 2} (0.1 - 1.0 atm) in the presence of excess steam (pH{sub 2}O/pCO{sub 2}>20) at 400-500{degrees}C and (b) fast sorption-desorption kinetics for CO{sub 2}, at 400-500{degrees}C. Several families of supported sorbents have been identified that meet the target CO{sub 2} capacity. A few of these sorbents have been tested under repeated sorption/desorption cycles and extended exposure to high pressure steam at 400-500{degrees}C. One sorbent has been scaled up to larger quantities (2-3 kg) and tested in the laboratory process equipment for sorption and desorption kinetics of CO{sub 2}. The CO{sub 2}, sorption and desorption kinetics are desirably fast. This was a critical path item for the first phase of the program and now has been successfully demonstrated. A reactor has been designed that will allow nearly isothermal operation for SERP-SMR. This reactor was integrated into an overall process flow diagram for the SERP-SMR process.

  18. Rotational spectrum, conformation and dipole moment of 4-methyl-1,3-dioxane

    NASA Astrophysics Data System (ADS)

    Shapkin, A. A.; Galeev, R. V.; Gunderova, L. N.; Fayzullin, M. G.; Mamleev, A. H.

    2006-12-01

    The rotational spectrum of 4-methyl-1,3-dioxane, C 5H 100 II, has been recorded from 16.0 to 40.0 GHz. The a-, b- and C- type transitions with J<=57 have been observed and assigned for the normal species in the ground vibrational state. The rotational constants and the quartic centrifugal distortion constants were determined to be A = 4802.335(2) MHz, B = 2376.163(1) MHz, C = 1738.852(1) MHz and Δ J = 0.1496(6) kHz, Δ JK = 0.157(5) kHz, Δ K = 0.76(3) kHz, δJ = 0.0423(1) kHz, δK 0.260(3) kHz. Stark effect measurements were used to determine the projections of the dipole moment on the principal inertial axes (in Debye units): μ a = 0.73(1), μ b = 1.32(1), c = 1.36(1) and μ tot = 2.03(2). Comparison of the experimental rotational constants and dipole moment components with results of ab initio calculations (B3PW91/aug-cc-pVDZ) shown that 4-methyl-l,3-dioxane exist in chair form with equatorial orientation of methyl group.

  19. Comprehensive physicochemical studies of a new hybrid material: 2-amino-4-methyl-3-nitropyridinium hydrogen oxalate.

    PubMed

    Bryndal, I; Kucharska, E; Wandas, M; Lorenc, J; Hermanowicz, K; Mączka, M; Lis, T; Marchewka, M; Hanuza, J

    2014-01-01

    A new organic-organic salt, 2-amino-4-methyl-3-nitropyridinium hydrogen oxalate (AMNPO), and its deuterium analogue have been synthesized and characterized by means of FT-IR, FT-Raman, DSC and single crystal X-ray studies. The DSC measurements and temperature dependence of the IR and Raman spectra in the range 4-295 K show that it undergoes a reversible phase transition at ~240 K. At room temperature it crystallizes in noncentrosymmetric space group P21. The unit-cell is built of the 2-amino-4-methyl-3-nitropyridinium cations and oxalate monoanions which are connected via the N-H···O and O-H···O hydrogen bonds. The geometrical and hydrogen bond parameters are similar for non-deuterated (at 120 and 293 K) and deuterated compounds (at 90K). The phase transition is probably a consequence of order-disorder transition inside of hydrogen network. The 6-311G(2d,2p) basis set with B3LYP functional have been used to discuss the structure and vibrational spectra of the studied compound. PMID:24013114

  20. A COMBINED REACTION/PRODUCT RECOVERY PROCESS FOR THE CONTINUOUS PRODUCTION OF BIODIESEL

    SciTech Connect

    Birdwell, J.F., Jr.; McFarlane, J.; Schuh, D.L.; Tsouris, C; Day, J.N.; Hullette, J.N.

    2009-09-01

    Oak Ridge National Laboratory (ORNL) and Nu-Energie, LLC entered into a Cooperative Research And Development Agreement (CRADA) for the purpose of demonstrating and deploying a novel technology for the continuous synthesis and recovery of biodiesel from the transesterification of triglycerides. The focus of the work was the demonstration of a combination Couette reactor and centrifugal separator - an invention of ORNL researchers - that facilitates both product synthesis and recovery from reaction byproducts in the same apparatus. At present, transesterification of triglycerides to produce biodiesel is performed in batch-type reactors with an excess of a chemical catalyst, which is required to achieve high reactant conversions in reasonable reaction times (e.g., 1 hour). The need for long reactor residence times requires use of large reactors and ancillary equipment (e.g., feed and product tankage), and correspondingly large facilities, in order to obtain the economy of scale required to make the process economically viable. Hence, the goal of this CRADA was to demonstrate successful, extended operation of a laboratory-scale reactor/separator prototype to process typical industrial reactant materials, and to design, fabricate, and test a production-scale unit for deployment at the biodiesel production site. Because of its ease of operation, rapid attainment of steady state, high mass transfer and phase separation efficiencies, and compact size, a centrifugal contactor was chosen for intensification of the biodiesel production process. The unit was modified to increase the residence time from a few seconds to minutes*. For this application, liquid phases were introduced into the reactor as separate streams. One was composed of the methanol and base catalyst and the other was the soy oil used in the experiments. Following reaction in the mixing zone, the immiscible glycerine and methyl ester products were separated in the high speed rotor and collected from separate

  1. GALS - setup for production and study of multinucleon transfer reaction products: present status

    NASA Astrophysics Data System (ADS)

    Zemlyanoy, S.; Zagrebaev, V.; Kozulin, E.; Kudryavtsev, Yu; Fedosseev, V.; Bark, R.; Janas, Z.

    2016-06-01

    This is a brief report on the current status of the new GAs cell based Laser ionization Setup (GALS) at Flerov Laboratory for Nuclear Reactions (FLNR) - JINR, Dubna. GALS is planned to exploit available beams from the U-400M cyclotron in low energy multi-nucleon transfer reactions to study exotic neutron-rich nuclei located in the "north-east" region of nuclear map. Products from 4.5 to 9 MeV/nucleon heavy-ion collisions, such as 136Xe on 208Pb, are to be captured in a gas cell and selectively laser-ionized in a sextupole (quadrupole) ion guide extraction system.

  2. Chemical Reaction and Flow Modeling in Fullerene and Nanotube Production

    NASA Technical Reports Server (NTRS)

    Scott, Carl D.; Farhat, Samir; Greendyke, Robert B.

    2004-01-01

    The development of processes to produce fullerenes and carbon nanotubes has largely been empirical. Fullerenes were first discovered in the soot produced by laser ablation of graphite [1]and then in the soot of electric arc evaporated carbon. Techniques and conditions for producing larger and larger quantities of fullerenes depended mainly on trial and error empirical variations of these processes, with attempts to scale them up by using larger electrodes and targets and higher power. Various concepts of how fullerenes and carbon nanotubes were formed were put forth, but very little was done based on chemical kinetics of the reactions. This was mainly due to the complex mixture of species and complex nature of conditions in the reactors. Temperatures in the reactors varied from several thousand degrees Kelvin down to near room temperature. There are hundreds of species possible, ranging from atomic carbon to large clusters of carbonaceous soot, and metallic catalyst atoms to metal clusters, to complexes of metals and carbon. Most of the chemical kinetics of the reactions and the thermodynamic properties of clusters and complexes have only been approximated. In addition, flow conditions in the reactors are transient or unsteady, and three dimensional, with steep spatial gradients of temperature and species concentrations. All these factors make computational simulations of reactors very complex and challenging. This article addresses the development of the chemical reaction involved in fullerene production and extends this to production of carbon nanotubes by the laser ablation/oven process and by the electric arc evaporation process. In addition, the high-pressure carbon monoxide (HiPco) process is discussed. The article is in several parts. The first one addresses the thermochemical aspects of modeling; and considers the development of chemical rate equations, estimates of reaction rates, and thermodynamic properties where they are available. The second part

  3. 40 CFR 721.9300 - Reaction products of substituted hydroxy-alkanes and polyalkylpolyisocyanatocarbomono- cycle.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9300 Reaction products of... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction products of...

  4. 40 CFR 721.10060 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, alkyl diglycidyl dibenzene...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... Specific Chemical Substances § 721.10060 Reaction product of alkylphenyl glycidyl ether... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of...

  5. 40 CFR 721.9300 - Reaction products of substituted hydroxy-alkanes and polyalkylpolyisocyanatocarbomono- cycle.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9300 Reaction products of... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction products of...

  6. 40 CFR 721.10060 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, alkyl diglycidyl dibenzene...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... Specific Chemical Substances § 721.10060 Reaction product of alkylphenyl glycidyl ether... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of...

  7. 40 CFR 721.9300 - Reaction products of substituted hydroxy-alkanes and polyalkylpolyisocyanatocarbomono- cycle.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9300 Reaction products of... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction products of...

  8. 40 CFR 721.10060 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, alkyl diglycidyl dibenzene...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Specific Chemical Substances § 721.10060 Reaction product of alkylphenyl glycidyl ether... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of...

  9. 40 CFR 721.9300 - Reaction products of substituted hydroxy-alkanes and polyalkylpolyisocyanatocarbomono- cycle.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9300 Reaction products of... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction products of...

  10. 40 CFR 721.9300 - Reaction products of substituted hydroxy-alkanes and polyalkylpolyisocyanatocarbomono- cycle.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9300 Reaction products of... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction products of...

  11. 40 CFR 721.10060 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, alkyl diglycidyl dibenzene...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... Specific Chemical Substances § 721.10060 Reaction product of alkylphenyl glycidyl ether... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of...

  12. 40 CFR 721.10060 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, alkyl diglycidyl dibenzene...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... Specific Chemical Substances § 721.10060 Reaction product of alkylphenyl glycidyl ether... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of...

  13. Preparation, characterization and catalyst application of ternary interpenetrating networks of poly 4-methyl vinyl pyridinium hydroxide-SiO{sub 2}-Al{sub 2}O{sub 3}

    SciTech Connect

    Kalbasi, Roozbeh Javad; Kolahdoozan, Majid; Vanani, Sedigheh Mozafari

    2011-08-15

    In this work, Al{sub 2}O{sub 3} was mixed with SiO{sub 2} and poly 4-vinylpyridine by the sol-gel method in order to make a composite which is used as a heterogeneous basic catalyst for Knoevenagel condensation reaction. The physical and chemical properties of the composite catalyst were investigated by XRD, FT-IR, TG, BET and SEM techniques. The catalytic performance of each material was determined for the Knoevenagel condensation reaction between carbonyl compound and malononitrile. The reactions were performed in solvent-free conditions and the product was obtained in high yield and purity after a simple work-up. The effects of the amount of catalyst, amount of monomer for the synthesis of composite and recyclability of the heterogeneous composite were investigated. The composite catalyst used for this synthetically useful transformation showed considerable level of reusability besides very good activity. - Graphical abstract: In this paper, we report the synthesis of poly 4-methyl vinyl pyridinium hydroxide-SiO{sub 2}-Al{sub 2}O{sub 3}. The novelty of this procedure is at easy preparation together with using inexpensive materials. Highlights: > P4MVPH-SiO{sub 2}-Al{sub 2}O{sub 3} composite was prepared as a novel polymer-inorganic hybrid. > The composite was prepared without using any bridged organosilanes compound. > SEM photograph showed that the composite is completely uniform. > P4MVPH-SiO{sub 2}-Al{sub 2}O{sub 3} could behave as a recyclable catalyst for Knoevenagel reaction.

  14. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    .... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester, reaction..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  15. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    .... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester, reaction..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  16. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    .... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester, reaction..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  17. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    .... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester, reaction..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  18. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    .... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester, reaction..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  19. X (3872) production from reactions involving D and D* mesons

    NASA Astrophysics Data System (ADS)

    Martínez Torres, A.; Khemchandani, K. P.; Navarra, F. S.; Nielsen, M.; Abreu, Luciano M.

    2015-07-01

    In this proceeding we show the results found for the cross sections of the processes D → πX(3872), *D → πX(3872) and *D* → πX(3872), information needed for calculations of the X (3872) abundance in heavy ion collisions. Our formalism is based on the generation of X(3872) from the interaction of the hadrons 0D*0 — c.c, D-D*+ — c.c and D-sD*+s — c.c. The evaluation of the cross section associated with processes having D* meson(s) involves an anomalous vertex, X*D*, which we have determined by considering triangular loops motivated by the molecular nature of X (3872). We find that the contribution of this vertex is important. Encouraged by this finding we estimate the X*D* coupling, which turns out to be 1.95 ± 0.22. We then use it to obtain the cross section for the reaction *D* → πX and find that the X*D* vertex is also relevant in this case. We also discuss the role of the charged components of X in the determination of the production cross sections.

  20. Crystal structures of HIV-1 nonnucleoside reverse transcriptase inhibitors: N-benzyl-4-methyl-benzimidazoles

    NASA Astrophysics Data System (ADS)

    Ziółkowska, Natasza E.; Michejda, Christopher J.; Bujacz, Grzegorz D.

    2009-07-01

    HIV-1 nonnucleoside reverse transcriptase inhibitors are potentially specific and effective drugs in AIDS therapy. The presence of two aromatic systems with an angled orientation in the molecule of the inhibitor is crucial for interactions with HIV-1 RT. The inhibitor drives like a wedge into the cluster of aromatic residues of RT HIV-1 and restrains the enzyme in a conformation that blocks the chemical step of nucleotide incorporation. Structural studies provide useful information for designing new, more active inhibitors. The crystal structures of four NNRTIs are presented here. The investigated compounds are derivatives of N-benzyl-4-methyl-benzimidazole with various aliphatic and aromatic substituents at carbon 2 positions and a 2,6-dihalogeno-substituted N-benzyl moiety. Structural data reported here show that the conformation of the investigated compounds is relatively rigid. Such feature is important for the nonnucleoside inhibitor binding to HIV-1 reverse transcriptase.

  1. Comparative analysis of the cytotoxicity of substituted (phenylglyoxal bis(4-methyl-3-thiosemicarbazone)) copper (II) chelates.

    PubMed

    Coats, E A; Milstein, S R; Holbein, G; McDonald, J; Reed, R; Petering, H G

    1976-01-01

    Seven para-substituted [phenylglyoxal bis(4-methyl-3-thiosemicarbazone)]copper (II) chelates (12-18) have been designed, synthesized, and tested for their ability to inhibit the respiration of rat liver slices as a normal cell model and Ehrlich ascites cells as a tumor cell model. Relationships between chemical structure and respiratory inhibition are described on a quantitative basis using substituent contants (pi, Es, and sigmap) by computerized multiparameter regression analyses. The correlations indicate that changes in Es have the largest effect on liver slice toxicity of chelates while pi and sigmap account for most of the variation in toxicity to ascites cells. A comparative analysis strongly suggests that electron-donating substituents with greater water solubility should increase cytotoxicity to ascites cells at the expense of cytotoxicity to the rat liver cells. The predictions of the equations were checked by synthesizing and testing an additional derivative. The results strengthen the initial predictions. PMID:1246035

  2. Shock compression response of poly(4-methyl-1-pentene) plastic to 985 GPa

    SciTech Connect

    Root, Seth Mattsson, Thomas R.; Cochrane, Kyle; Lemke, Raymond W.; Knudson, Marcus D.

    2015-11-28

    Poly(4-methyl-1-pentene) plastic (PMP) is a hydrocarbon polymer with potential applications to inertial confinement fusion experiments and as a Hugoniot impedance matching standard for equation of state experiments. Using Sandia's Z-machine, we performed a series of flyer plate experiments to measure the principal Hugoniot and reshock states of PMP up to 985 GPa. The principal Hugoniot measurements validate density functional theory (DFT) calculations along the Hugoniot. The DFT calculations are further analyzed using a bond tracking method to understand the dissociation pathway under shock compression. Complete dissociation occurs at a compression factor similar to other sp3-hybridized, C-C bonded systems, which suggests a limiting compression for C-C bonds. The combined experimental and DFT results provide a solid basis for constructing an equation of state model for PMP.

  3. Shock compression response of poly(4-methyl-1-pentene) plastic to 985 GPa

    NASA Astrophysics Data System (ADS)

    Root, Seth; Mattsson, Thomas R.; Cochrane, Kyle; Lemke, Raymond W.; Knudson, Marcus D.

    2015-11-01

    Poly(4-methyl-1-pentene) plastic (PMP) is a hydrocarbon polymer with potential applications to inertial confinement fusion experiments and as a Hugoniot impedance matching standard for equation of state experiments. Using Sandia's Z-machine, we performed a series of flyer plate experiments to measure the principal Hugoniot and reshock states of PMP up to 985 GPa. The principal Hugoniot measurements validate density functional theory (DFT) calculations along the Hugoniot. The DFT calculations are further analyzed using a bond tracking method to understand the dissociation pathway under shock compression. Complete dissociation occurs at a compression factor similar to other sp3-hybridized, C-C bonded systems, which suggests a limiting compression for C-C bonds. The combined experimental and DFT results provide a solid basis for constructing an equation of state model for PMP.

  4. Mesoscale simulation of shocked poly-(4-methyl-1-pentene) (PMP) foams.

    SciTech Connect

    Schroen, Diana Grace; Flicker, Dawn G.; Haill, Thomas A.; Root, Seth; Mattsson, Thomas Kjell Rene

    2011-06-01

    Hydrocarbon foams are commonly used in HEDP experiments, and are subject to shock compression from tens to hundreds of GPa. Modeling foams is challenging due to the heterogeneous character of the foam. A quantitative understanding of foams under strong dynamic compression is sought. We use Sandia's ALEGRA-MHD code to simulate 3D mesoscale models of pure poly(4-methyl-1-petene) (PMP) foams. We employ two models of the initial polymer-void structure of the foam and analyze the statistical properties of the initial and shocked states. We compare the simulations to multi-Mbar shock experiments at various initial foam densities and flyer impact velocities. Scatter in the experimental data may be a consequence of the initial foam inhomogeneity. We compare the statistical properties the simulations with the scatter in the experimental data.

  5. Production of unknown transactinides in asymmetry-exit-channel quasifission reactions

    SciTech Connect

    Adamian, G.G.; Antonenko, N. V.; Zubov, A. S.

    2005-03-01

    Possibilities of production of new isotopes of superheavy nuclei with charge numbers 104-108 in asymmetry-exit-channel quasifission reactions are studied for the first time. The optimal conditions for the synthesis are suggested in this type of reaction. The products of suggested reactions can fill a gap of unknown isotopes between the isotopes of heaviest nuclei obtained in cold and hot complete fusion reactions.

  6. Histone H3 Acetylation and H3 K4 Methylation Define Distinct Chromatin Regions Permissive for Transgene Expression

    PubMed Central

    Yan, Chunhong; Boyd, Douglas D.

    2006-01-01

    Histone modifications are associated with distinct transcription states and serve as heritable epigenetic markers for chromatin structure and function. While H3 K9 methylation defines condensed heterochromatin that is able to silence a nearby gene, how gene silencing within euchromatin regions is achieved remains elusive. We report here that histone H3 K4 methylation or K9/K14 acetylation defines distinct chromatin regions permissive or nonpermissive for transgene expression. A permissive chromatin region is enriched in H3 K4 methylation and H3 acetylation, while a nonpermissive region is poor in or depleted of these two histone modifications. The histone modification states of the permissive chromatin can spread to transgenic promoters. However, de novo histone H3 acetylation and H3 K4 methylation at a transgenic promoter in a nonpermissive chromatin region are stochastic, leading to variegated transgene expression. Moreover, nonpermissive chromatin progressively silences a transgene, an event that is accompanied by the reduction of H3 K4 methylation and H3 acetylation levels at the transgenic promoter. These repressive effects of nonpermissive chromatin cannot be completely countered by strong transcription activators, indicating the dominance of the chromatin effects. We therefore propose a model in which histone H3 acetylation and H3 K4 methylation localized to discrete sites in the mammalian genome mark distinct chromatin functions that dictate transgene expression or silencing. PMID:16914722

  7. [Preparation and applications of 4-methyl imidazole magnetic surface molecularly imprinted polymers].

    PubMed

    Qi, Yuxia; Zhao, Lijuan; Ma, Meihua; Wei, Chanling; Li, Ya; Li, Wenjing; Gong, Bolin

    2015-12-01

    The magnetic surface molecularly imprinted polymers (MIPs) with specific recognition of 4-methyl imidazole (4-MI) were prepared by using 4-MI as template molecule, methacrylic acid (MAA) as functional monomer and Fe3O4 as magnetic fluid. The polymers were characterized by of Fourier transform infrared spectrometer (FT-IR) analysis, X-ray diffraction (XRD) analysis, transmission electron microscopy (TEM) and vibrating sample magnetometer (VSM). The results demonstrated that an imprinted polymer layer was successfully coated onto the surface of modified Fe3O4 nanomaterials, resulting in a narrow diameter distribution and good magnetic responsibility. The ultraviolet (UV) spectrophotometry was used to demonstrate the interaction between 4-MI and MAA. It was found that one 4-MI molecule was entrapped by one MAA molecule, which was the main existing form of subject and object. By UV spectrophotometric method to study the adsorption performance of magnetic molecularly imprinted polymers, the specific adsorption equilibrium and selectivity were evaluated by batch rebinding studies. The Scatchard analysis showed that there were two kinds of binding sites in the Fe3O4 @ (4-MI-MIP). The corresponding maximum adsorption capacities of 4-MI onto Fe3O4 @ (4-MI-MIP) were 40.31 mg/g and 23.07 mg/g, and the dissociation constants were 64.85 mg/L and 30.41 mg/L, respectively. The kinetic experimental data were correlated with second-order kinetic model. The magnetic molecularly imprinted polymers were used for the adsorption of 4-methyl imidazole in environmental water samples, and good results were obtained. PMID:27097456

  8. Significance of melatonin in antioxidative defense system: reactions and products.

    PubMed

    Tan, D X; Manchester, L C; Reiter, R J; Qi, W B; Karbownik, M; Calvo, J R

    2000-01-01

    Melatonin is a potent endogenous free radical scavenger, actions that are independent of its many receptor-mediated effects. In the last several years, hundreds of publications have confirmed that melatonin is a broad-spectrum antioxidant. Melatonin has been reported to scavenge hydrogen peroxide (H(2)O(2)), hydroxyl radical (HO(.)), nitric oxide (NO(.)), peroxynitrite anion (ONOO(-)), hypochlorous acid (HOCl), singlet oxygen ((1)O(2)), superoxide anion (O(2)(-).) and peroxyl radical (LOO(.)), although the validity of its ability to scavenge O(2)(-). and LOO(.) is debatable. Regardless of the radicals scavenged, melatonin prevents oxidative damage at the level of cells, tissues, organs and organisms. The antioxidative mechanisms of melatonin seem different from classical antioxidants such as vitamin C, vitamin E and glutathione. As electron donors, classical antioxidants undergo redox cycling; thus, they have the potential to promote oxidation as well as prevent it. Melatonin, as an electron-rich molecule, may interact with free radicals via an additive reaction to form several stable end-products which are excreted in the urine. Melatonin does not undergo redox cycling and, thus, does not promote oxidation as shown under a variety of experimental conditions. From this point of view, melatonin can be considered a suicidal or terminal antioxidant which distinguishes it from the opportunistic antioxidants. Interestingly, the ability of melatonin to scavenge free radicals is not in a ratio of mole to mole. Indeed, one melatonin molecule scavenges two HO. Also, its secondary and tertiary metabolites, for example, N(1)-acetyl-N(2)-formyl-5-methoxykynuramine, N-acetyl-5-methoxykynuramine and 6-hydroxymelatonin, which are believed to be generated when melatonin interacts with free radicals, are also regarded as effective free radical scavengers. The continuous free radical scavenging potential of the original molecule (melatonin) and its metabolites may be defined as a

  9. Sporicidal effects of iodine-oxide thermite reaction products

    NASA Astrophysics Data System (ADS)

    Russell, Rod; Bless, Stephan; Blinkova, Alexandra; Chen, Tiffany

    2012-03-01

    Iodine pentoxide-aluminum thermite reactions have been driven by impacts at 1000 m/s on steel plates 3 mm or thicker. This reaction releases iodine gas that is known to be a sporicide. To test the impact reactions for sporicidal effects, reactions took place in closed chambers containing dried Bacillus subtilis spores. The reduction in colony-forming units was dependent on the exposure time; long exposure times resulted in a 105 decrease in germination rate. This was shown to be due to the gas exposure rather than the heat or turbulence. Sporicidal effectiveness was increased by adding neodymium and saran resin.

  10. Gamma ray line production from cosmic ray spallation reactions

    NASA Technical Reports Server (NTRS)

    Silberberg, R.; Tsao, C. H.; Letaw, J. R.

    1985-01-01

    The gamma ray line intensities due to cosmic ray spallation reactions in clouds, the galactic disk and accreting binary pulsars are calculated. With the most favorable plausible assumptions, only a few lines may be detectable to the level of 0.0000001 per sq. cm per sec. The intensities are compared with those generated in nuclear excitation reactions.

  11. Sporicidal Effects of Iodine-oxide Thermite Reaction Products

    NASA Astrophysics Data System (ADS)

    Russell, Rod; Bless, Stephan; Blinkova, Alexandra; Chen, Tiffany; InstituteAdvanced Tehnology Collaboration; Dept of Molecular Genetics; Microbiology-UT Austin Collaboration; Chemistry; Biochemistry-UT Austin Collaboration

    2011-06-01

    Iodine pentoxide-aluminum thermite reactions have been driven by impacts at 1000 m/s on steel plates 3 mm or thicker. The activation energy of this material reaction is 197 J/g. The reactivity is increased by reducing grain size. This reaction releases iodine gas that is known to be a sporicide. In order to test the impact reactions for sporicidal effects, reactions took place in closed chambers containing dried Bacillus subtilis spores. The reduction in colony-forming units was dependent on the exposure time; long exposure times resulted in a 105 decrease in germination rate. This was shown to be due to the gas exposure and not the heat or turbulence. Sporicidal effectiveness was increased by adding neodymium and saran resin. The sporicidal effect is very dependent on exposure time, ranging from about 90% kill for times on the order of a second to 99.99% for one-hour times.

  12. Maleic anhydride-polyether-polyamine reaction product and motor fuel composition containing same

    SciTech Connect

    Sung, R.L.

    1987-04-21

    A material is described having a use as a motor fuel additive for controlling engine octane requirement increase (ORI), controlling and reducing hydrocarbon and carbon monoxide engine emissions, and having carburetor detergency properties. The material is the reaction product of maleic anhydride, a polyether polyamine, preferably a polyether diamine, and a hydrocarbyl polyamine, preferably an n-alkyl-alkylene diamine. A concentrate comprising the prescribed reaction product dissolved in a hydrocarbon solvent is also described. Motor fuels containing the reaction product additive of the instant invention show improved ORI control and carburetor detergency in comparison with motor fuels without the reaction product additive.

  13. 40 CFR 721.10211 - Octadecanoic acid, reaction products with diethylenetriamine and urea, acetates.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10211 Octadecanoic acid, reaction... subject to reporting. (1) The chemical substance identified as octadecanoic acid, reaction products with... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Octadecanoic acid, reaction...

  14. 40 CFR 721.10211 - Octadecanoic acid, reaction products with diethylenetriamine and urea, acetates.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10211 Octadecanoic acid, reaction... subject to reporting. (1) The chemical substance identified as octadecanoic acid, reaction products with... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Octadecanoic acid, reaction...

  15. 40 CFR 721.10211 - Octadecanoic acid, reaction products with diethylenetriamine and urea, acetates.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10211 Octadecanoic acid, reaction... subject to reporting. (1) The chemical substance identified as octadecanoic acid, reaction products with... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Octadecanoic acid, reaction...

  16. 40 CFR 721.10211 - Octadecanoic acid, reaction products with diethylenetriamine and urea, acetates.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10211 Octadecanoic acid, reaction... subject to reporting. (1) The chemical substance identified as octadecanoic acid, reaction products with... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Octadecanoic acid, reaction...

  17. Thermochemical hydrogen production via a cycle using barium and sulfur - Reaction between barium sulfide and water

    NASA Technical Reports Server (NTRS)

    Ota, K.; Conger, W. L.

    1977-01-01

    The reaction between barium sulfide and water, a reaction found in several sulfur based thermochemical cycles, was investigated kinetically at 653-866 C. Gaseous products were hydrogen and hydrogen sulfide. The rate determining step for hydrogen formation was a surface reaction between barium sulfide and water. An expression was derived for the rate of hydrogen formation.

  18. Polumeric electrode coated with reaction product of cyclic compound

    SciTech Connect

    Maxfield, M.; Elsenbaumer, R.L.; Shacklette, L.W.

    1984-09-18

    Batteries are disclosed with electrodes, especially cathodes, having a conjugated backbone polymer such as polyacetylene as electroactive material and a coating. The coating is formed by reaction between the oxidized polymer and a pyrrole, thiophene, azulene, furan or aniline compound.

  19. Laser ion source for multi-nucleon transfer reaction products

    NASA Astrophysics Data System (ADS)

    Hirayama, Y.; Watanabe, Y. X.; Imai, N.; Ishiyama, H.; Jeong, S. C.; Miyatake, H.; Oyaizu, M.; Kimura, S.; Mukai, M.; Kim, Y. H.; Sonoda, T.; Wada, M.; Huyse, M.; Kudryavtsev, Yu.; Van Duppen, P.

    2015-06-01

    We have developed a laser ion source for the target-like fragments (TLFs) produced in multi-nucleon transfer (MNT) reactions. The operation principle of the source is based on the in-gas laser ionization and spectroscopy (IGLIS) approach. In the source TLFs are thermalized and neutralized in high pressure and high purity argon gas, and are extracted after being selectively re-ionized in a multi-step laser resonance ionization process. The laser ion source has been implemented at the KEK Isotope Separation System (KISS) for β-decay spectroscopy of neutron-rich isotopes with N = 126 of nuclear astrophysical interest. The simulations of gas flow and ion-beam optics have been performed to optimize the gas cell for efficient thermalization and fast transporting the TLFs, and the mass-separator for efficient transport with high mass-resolving power, respectively. To confirm the performances expected at the design stage, off-line experiments have been performed by using 56Fe atoms evaporated from a filament in the gas cell. The gas-transport time of 230 ms in the argon cell and the measured KISS mass-resolving power of 900 are consistent with the designed values. The high purity of the gas-cell system, which is extremely important for efficient and highly-selective production of laser ions, was achieved and confirmed from the mass distribution of the extracted ions. After the off-line tests, on-line experiments were conducted by directly injecting energetic 56Fe beam into the gas cell. After thermalization of the injected 56Fe beam, laser-produced singly-charged 56Fe+ ions were extracted. The extraction efficiency and selectivity of the gas cell in the presence of plasma induced by 56Fe beam injection as well as the time profile of the extracted ions were investigated; extraction efficiency of 0.25%, a beam purity of >99% and an extraction time of 270 ms. It has been confirmed that the performance of the KISS laser ion source is satisfactory to start the measurements of

  20. Product distribution for the reaction of HO2 with ClO

    NASA Technical Reports Server (NTRS)

    Leu, M.-T.

    1980-01-01

    The paper reports the direct measurement of the reaction product HOCl from the reaction of H2O with ClO, and sets an upper limit for the possible product O3, using a discharge flow/mass spectrometry/resonance fluorescence apparatus. The upper limits of the reaction channel producing HCl + O3 are 1.5% at 298 K and 3.0% at 248 K. It is seen that the HCl production rate from the HO2 + ClO reaction could be as large as that from the Cl + CH4 reaction in the lower and middle stratosphere. Thus, this reaction may possibly increase the HCl production rate appreciably and thereby reduce the calculated O3 destruction by chlorofluoromethanes.

  1. Dynamical Effects and Product Distributions in Simulated CN + Methane Reactions.

    PubMed

    Preston, Thomas J; Hornung, Balázs; Pandit, Shubhrangshu; Harvey, Jeremy N; Orr-Ewing, Andrew J

    2016-07-14

    Dynamics of collisions between structured molecular species quickly become complex as molecules become large. Reactions of methane with halogen and oxygen atoms serve as model systems for polyatomic molecule chemical dynamics, and replacing the atomic reagent with a diatomic radical affords further insights. A new, full-dimensional potential energy surface for collisions between CN + CH4 to form HCN + CH3 is developed and then used to perform quasi-classical simulations of the reaction. Coupled-cluster energies serve as input to an empirical valence bonding (EVB) model, which provides an analytical function for the surface. Efficient sampling permits simulation of velocity-map ion images and exploration of dynamics over a range of collision energies. Reaction populates HCN vibration, and energy partitioning changes with collision energy. The reaction cross-section depends on the orientation of the diatomic CN radical. A two-dimensional extension of the cone of acceptance for an atom in the line-of-centers model appropriately describes its reactivity. The simulation results foster future experiments and diatomic extensions to existing atomic models of chemical collisions and reaction dynamics. PMID:26812395

  2. 40 CFR 721.10448 - Acetic acid, hydroxy- methoxy-, methyl ester, reaction products with substituted alkylamine...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... ester, reaction products with substituted alkylamine (generic). 721.10448 Section 721.10448 Protection... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10448 Acetic acid, hydroxy- methoxy-, methyl ester, reaction products with substituted alkylamine (generic)....

  3. 40 CFR 721.10301 - Reaction products of fatty alcohols, (aminoethylaminopropyl) dialkoxymethylsilane, glycidol, and...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... uses subject to reporting. (1) The chemical substance identified generically as reaction products of... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction products of fatty alcohols... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  4. 40 CFR 721.9270 - Reaction product of epoxy with anhydride and glycerol and glycol.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9270 Reaction product of epoxy with anhydride and... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of epoxy...

  5. 40 CFR 721.2582 - Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of alkylene diamine... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2582 Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine (generic)....

  6. 40 CFR 721.10210 - Soybean oil, epoxidized, reaction products with diethanolamine.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10210 Soybean oil, epoxidized, reaction products... chemical substance identified as soybean oil, epoxidized, reaction products with diethanolamine (PMN P-09... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Soybean oil, epoxidized,...

  7. 40 CFR 721.10574 - Alkylcarboxy polyester acrylate reaction products with mixed metal oxides (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... reaction products with mixed metal oxides (generic). (a) Chemical substance and significant new uses... reaction products with mixed metal oxides (generic). 721.10574 Section 721.10574 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  8. 40 CFR 721.10059 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of alkylphenyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10059 Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

  9. 40 CFR 721.524 - Alcohols, C6-12, ethoxylated, reaction product with maleic anhydride.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... New Uses for Specific Chemical Substances § 721.524 Alcohols, C6-12, ethoxylated, reaction product... chemical substance identified generically as alcohols, C6-12, ethoxylated, reaction product with maleic... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Alcohols, C6-12, ethoxylated,...

  10. 40 CFR 721.2582 - Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of alkylene diamine... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2582 Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine (generic)....

  11. 40 CFR 721.10212 - 1,2-Ethanediol, reaction products with epichlorohydrin.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10212 1,2-Ethanediol, reaction products with epichlorohydrin. (a... 40 Protection of Environment 32 2013-07-01 2013-07-01 false 1,2-Ethanediol, reaction products...

  12. 40 CFR 721.10448 - Acetic acid, hydroxy- methoxy-, methylester, reaction products with substituted alkylamine...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...-, methylester, reaction products with substituted alkylamine (generic). 721.10448 Section 721.10448 Protection... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10448 Acetic acid, hydroxy- methoxy-, methylester, reaction products with substituted alkylamine (generic)....

  13. 40 CFR 721.9285 - Reaction products of formalin (37%) with amine C12.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9285 Reaction products of formalin (37%) with amine C12. (a) Chemical... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction products of formalin...

  14. 40 CFR 721.8085 - Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of substituted... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.8085 Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated (generic)....

  15. 40 CFR 721.2625 - Reaction product of alkane-diol and epichlorohydrin.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2625 Reaction product of alkane-diol and epichlorohydrin. (a) Chemical... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of alkane-diol...

  16. 40 CFR 721.2582 - Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of alkylene diamine... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2582 Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine (generic)....

  17. 40 CFR 721.9265 - Reaction product of dichlorobenzidine and substituted alkylamide.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9265 Reaction product of dichlorobenzidine and... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of...

  18. 40 CFR 721.2625 - Reaction product of alkane-diol and epichlorohydrin.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2625 Reaction product of alkane-diol and epichlorohydrin. (a) Chemical... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of alkane-diol...

  19. 40 CFR 721.9270 - Reaction product of epoxy with anhydride and glycerol and glycol.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9270 Reaction product of epoxy with anhydride and... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of epoxy...

  20. 40 CFR 721.10212 - 1,2-Ethanediol, reaction products with epichlorohydrin.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10212 1,2-Ethanediol, reaction products with epichlorohydrin. (a... 40 Protection of Environment 32 2012-07-01 2012-07-01 false 1,2-Ethanediol, reaction products...

  1. 40 CFR 721.10058 - Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of alkylphenol... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10058 Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

  2. 40 CFR 721.8085 - Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of substituted... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.8085 Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated (generic)....

  3. 40 CFR 721.10212 - 1,2-Ethanediol, reaction products with epichlorohydrin.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10212 1,2-Ethanediol, reaction products with epichlorohydrin. (a... 40 Protection of Environment 31 2011-07-01 2011-07-01 false 1,2-Ethanediol, reaction products...

  4. 40 CFR 721.10058 - Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of alkylphenol... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10058 Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

  5. 40 CFR 721.10059 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of alkylphenyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10059 Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

  6. 40 CFR 721.10484 - Siloxanes and Silicones, Me vinyl, hydroxy-terminated, reaction products with...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10484 Siloxanes and Silicones, Me vinyl, hydroxy-terminated, reaction products with -modified silica. (a) Chemical substance and..., hydroxy-terminated, reaction products with -modified silica. 721.10484 Section 721.10484 Protection...

  7. 40 CFR 721.10059 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of alkylphenyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10059 Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

  8. 40 CFR 721.524 - Alcohols, C6-12, ethoxylated, reaction product with maleic anhydride.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... New Uses for Specific Chemical Substances § 721.524 Alcohols, C6-12, ethoxylated, reaction product... chemical substance identified generically as alcohols, C6-12, ethoxylated, reaction product with maleic... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Alcohols, C6-12, ethoxylated,...

  9. 40 CFR 721.10464 - Fatty acid, reaction products with alkanolamine (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10464 Fatty acid, reaction products with alkanolamine (generic). (a... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Fatty acid, reaction products...

  10. 40 CFR 721.10301 - Reaction products of fatty alcohols, (aminoethylaminopropyl) dialkoxymethylsilane, glycidol, and...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... uses subject to reporting. (1) The chemical substance identified generically as reaction products of... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction products of fatty alcohols... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  11. 40 CFR 721.10251 - Fatty acids, reaction products with alkanolamine (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10251 Fatty acids, reaction products with alkanolamine (generic). (a... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Fatty acids, reaction products...

  12. 40 CFR 721.10210 - Soybean oil, epoxidized, reaction products with diethanolamine.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10210 Soybean oil, epoxidized, reaction products... chemical substance identified as soybean oil, epoxidized, reaction products with diethanolamine (PMN P-09... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Soybean oil, epoxidized,...

  13. 40 CFR 721.10574 - Alkylcarboxy polyester acrylate reaction products with mixed metal oxides (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... reaction products with mixed metal oxides (generic). (a) Chemical substance and significant new uses... reaction products with mixed metal oxides (generic). 721.10574 Section 721.10574 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  14. 40 CFR 721.9285 - Reaction products of formalin (37%) with amine C12.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9285 Reaction products of formalin (37%) with amine C12. (a) Chemical... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction products of formalin...

  15. 40 CFR 721.10360 - 1-Substituted propane, 3-(triethoxysilyl)-, reaction products with polyethylene glycol mono...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...-(triethoxysilyl)-, reaction products with polyethylene glycol mono-(branched tridecyl) ether (generic). 721.10360... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10360 1-Substituted propane, 3-(triethoxysilyl)-, reaction products with polyethylene...

  16. 40 CFR 721.2582 - Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of alkylene diamine... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2582 Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine (generic)....

  17. 40 CFR 721.10358 - Formaldehyde reaction products with aryl amine (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10358 Formaldehyde reaction products with aryl amine... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Formaldehyde reaction products...

  18. 40 CFR 721.9265 - Reaction product of dichlorobenzidine and substituted alkylamide.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9265 Reaction product of dichlorobenzidine and... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of...

  19. 40 CFR 721.10360 - 1-Substituted propane, 3-(triethoxysilyl)-, reaction products with polyethylene glycol mono...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...-(triethoxysilyl)-, reaction products with polyethylene glycol mono-(branched tridecyl) ether (generic). 721.10360... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10360 1-Substituted propane, 3-(triethoxysilyl)-, reaction products with polyethylene...

  20. 40 CFR 721.10212 - 1,2-Ethanediol, reaction products with epichlorohydrin.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10212 1,2-Ethanediol, reaction products with epichlorohydrin. (a... 40 Protection of Environment 31 2014-07-01 2014-07-01 false 1,2-Ethanediol, reaction products...

  1. 40 CFR 721.10301 - Reaction products of fatty alcohols, (aminoethylaminopropyl) dialkoxymethylsilane, glycidol, and...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... uses subject to reporting. (1) The chemical substance identified generically as reaction products of... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction products of fatty alcohols... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific...

  2. 40 CFR 721.524 - Alcohols, C6-12, ethoxylated, reaction product with maleic anhydride.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... New Uses for Specific Chemical Substances § 721.524 Alcohols, C6-12, ethoxylated, reaction product... chemical substance identified generically as alcohols, C6-12, ethoxylated, reaction product with maleic... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Alcohols, C6-12, ethoxylated,...

  3. 40 CFR 721.10484 - Siloxanes and Silicones, Me vinyl, hydroxy-terminated, reaction products with...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10484 Siloxanes and Silicones, Me vinyl, hydroxy-terminated, reaction products with -modified silica. (a) Chemical substance and..., hydroxy-terminated, reaction products with -modified silica. 721.10484 Section 721.10484 Protection...

  4. 40 CFR 721.10358 - Formaldehyde reaction products with aryl amine (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10358 Formaldehyde reaction products with aryl amine... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Formaldehyde reaction products...

  5. 40 CFR 721.8085 - Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of substituted... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.8085 Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated (generic)....

  6. 40 CFR 721.8085 - Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of substituted... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.8085 Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated (generic)....

  7. 40 CFR 721.9270 - Reaction product of epoxy with anhydride and glycerol and glycol.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9270 Reaction product of epoxy with anhydride and... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of epoxy...

  8. 40 CFR 721.10210 - Soybean oil, epoxidized, reaction products with diethanolamine.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10210 Soybean oil, epoxidized, reaction products... chemical substance identified as soybean oil, epoxidized, reaction products with diethanolamine (PMN P-09... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Soybean oil, epoxidized,...

  9. 40 CFR 721.8085 - Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of substituted... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.8085 Reaction product of substituted aromatic diol, formaldehyde and alkanolamine, propoxylated (generic)....

  10. 40 CFR 721.2625 - Reaction product of alkane-diol and epichlorohydrin.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2625 Reaction product of alkane-diol and epichlorohydrin. (a) Chemical... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of alkane-diol...

  11. 40 CFR 721.9270 - Reaction product of epoxy with anhydride and glycerol and glycol.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9270 Reaction product of epoxy with anhydride and... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of epoxy...

  12. 40 CFR 721.9285 - Reaction products of formalin (37%) with amine C12.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9285 Reaction products of formalin (37%) with amine C12. (a) Chemical... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction products of formalin...

  13. 40 CFR 721.9265 - Reaction product of dichlorobenzidine and substituted alkylamide.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9265 Reaction product of dichlorobenzidine and... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of...

  14. 40 CFR 721.9265 - Reaction product of dichlorobenzidine and substituted alkylamide.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9265 Reaction product of dichlorobenzidine and... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of...

  15. 40 CFR 721.10058 - Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of alkylphenol... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10058 Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

  16. 40 CFR 721.9265 - Reaction product of dichlorobenzidine and substituted alkylamide.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9265 Reaction product of dichlorobenzidine and... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of...

  17. 40 CFR 721.10059 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of alkylphenyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10059 Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

  18. 40 CFR 721.10058 - Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of alkylphenol... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10058 Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

  19. 40 CFR 721.9285 - Reaction products of formalin (37%) with amine C12.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9285 Reaction products of formalin (37%) with amine C12. (a) Chemical... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction products of formalin...

  20. 40 CFR 721.10251 - Fatty acids, reaction products with alkanolamine (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10251 Fatty acids, reaction products with alkanolamine (generic). (a... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Fatty acids, reaction products...

  1. 40 CFR 721.2625 - Reaction product of alkane-diol and epichlorohydrin.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2625 Reaction product of alkane-diol and epichlorohydrin. (a) Chemical... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of alkane-diol...

  2. 40 CFR 721.10358 - Formaldehyde reaction products with aryl amine (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10358 Formaldehyde reaction products with aryl amine... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Formaldehyde reaction products...

  3. 40 CFR 721.10210 - Soybean oil, epoxidized, reaction products with diethanolamine.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Significant New Uses for Specific Chemical Substances § 721.10210 Soybean oil, epoxidized, reaction products... chemical substance identified as soybean oil, epoxidized, reaction products with diethanolamine (PMN P-09... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Soybean oil, epoxidized,...

  4. 40 CFR 721.10679 - Carboxylic acid, substituted alkylstannylene ester, reaction products with inorganic acid tetra...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... alkylstannylene ester, reaction products with inorganic acid tetra alkyl ester (generic). 721.10679 Section 721... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10679 Carboxylic acid, substituted alkylstannylene ester, reaction products with inorganic acid tetra alkyl...

  5. 40 CFR 721.10464 - Fatty acid, reaction products with alkanolamine (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10464 Fatty acid, reaction products with alkanolamine (generic). (a... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Fatty acid, reaction products...

  6. 40 CFR 721.10360 - 1-Substituted propane, 3-(triethoxysilyl)-, reaction products with polyethylene glycol mono...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...-(triethoxysilyl)-, reaction products with polyethylene glycol mono-(branched tridecyl) ether (generic). 721.10360... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10360 1-Substituted propane, 3-(triethoxysilyl)-, reaction products with polyethylene...

  7. 40 CFR 721.9270 - Reaction product of epoxy with anhydride and glycerol and glycol.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9270 Reaction product of epoxy with anhydride and... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of epoxy...

  8. 40 CFR 721.2625 - Reaction product of alkane-diol and epichlorohydrin.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2625 Reaction product of alkane-diol and epichlorohydrin. (a) Chemical... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of alkane-diol...

  9. 40 CFR 721.10059 - Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of alkylphenyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10059 Reaction product of alkylphenyl glycidyl ether, polyalkylenepolyamine, and alkyl diglycidyl...

  10. 40 CFR 721.2582 - Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of alkylene diamine... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.2582 Reaction product of alkylene diamine, MDl, substituted carbomonocyclic amine and alkylamine (generic)....

  11. 40 CFR 721.10058 - Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of alkylphenol... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10058 Reaction product of alkylphenol, aromatic cyclicamine, alkyl diglycidyl dibenzene, and...

  12. 40 CFR 721.10251 - Fatty acids, reaction products with alkanolamine (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10251 Fatty acids, reaction products with alkanolamine (generic). (a... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Fatty acids, reaction products...

  13. 40 CFR 721.524 - Alcohols, C6-12, ethoxylated, reaction product with maleic anhydride.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... New Uses for Specific Chemical Substances § 721.524 Alcohols, C6-12, ethoxylated, reaction product... chemical substance identified generically as alcohols, C6-12, ethoxylated, reaction product with maleic... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Alcohols, C6-12, ethoxylated,...

  14. 40 CFR 721.524 - Alcohols, C6-12, ethoxylated, reaction product with maleic anhydride.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... New Uses for Specific Chemical Substances § 721.524 Alcohols, C6-12, ethoxylated, reaction product... chemical substance identified generically as alcohols, C6-12, ethoxylated, reaction product with maleic... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Alcohols, C6-12, ethoxylated,...

  15. 40 CFR 721.4468 - 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false 1H-Imidazole, 2-ethyl-4,5-dihydro-4... Specific Chemical Substances § 721.4468 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as...

  16. 40 CFR 721.4468 - 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false 1H-Imidazole, 2-ethyl-4,5-dihydro-4... Specific Chemical Substances § 721.4468 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as...

  17. 40 CFR 721.4468 - 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false 1H-Imidazole, 2-ethyl-4,5-dihydro-4... Specific Chemical Substances § 721.4468 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as...

  18. 40 CFR 721.4468 - 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false 1H-Imidazole, 2-ethyl-4,5-dihydro-4... Specific Chemical Substances § 721.4468 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as...

  19. 40 CFR 721.4468 - 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false 1H-Imidazole, 2-ethyl-4,5-dihydro-4... Specific Chemical Substances § 721.4468 1H-Imidazole, 2-ethyl-4,5-dihydro-4-methyl-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as...

  20. Preparation of 1-fluoro-4-methyl-9H-[carbonyl-(14) C]thioxanthen-9-one and amine derivatives.

    PubMed

    Javaheri, Mohsen; Shirvani, Gholamhossein; Amini, Mohsen; Saemian, Nader; Saadatjoo, Naghi

    2016-06-30

    9H-Thioxanthen-9-ones are an important class of compound and are a common heterocyclic scaffold in biologically active and medicinally significant compounds. In this paper the synthesis of 1-fluoro-4-methyl-9H-thioxanthen-9-one and some amine derivatives labeled with carboxyl-14 is described. PMID:27157134

  1. INTRAMOLECULAR MOTION AND REORIENTATIONAL BARRIERS IN 9-FLUORENONE, 4-METHYL-9-FLUORENONE AND 4,5-DIMETHYL-9-FLUORENONE

    EPA Science Inventory

    Carbon-13 nuclear magnetic resonance spin-lattice relaxation times and nuclear Overhauser enhancements were measured as functions of temperature for the hydrogen-bearing carbons in 9-fluorenone, 4-methyl-9-fluorenone, and 4,5-dimethyl-9-fluorenone. Reorientational diffusion const...

  2. Synthetic, structural and kinetic studies on the binding of cyclohexane-1,2-bis(4-methyl-3-thiosemicarbazone) to divalent metal ions (Co, Ni, Cu, Zn or Cd).

    PubMed

    Al-Karawi, Ahmed Jasim M; Clegg, William; Harrington, Ross W; Henderson, Richard A

    2009-01-21

    The reactions of cyclohexane-1,2-bis(4-methyl-3-thiosemicarbazone) (CHMTSC) with MCl2 (M = Co, Ni, Cu or Zn) and Cd(NO3)2 have been shown to produce complexes in which the thiosemicarbazone has been doubly deprotonated [[M(CHMTSC - 2H+)] (M = Co, Ni or Ni)], analogous to those reported earlier with other Schiff base thiosemicarbazones. However, with ZnCl2 and Cd(NO3)2, the complexes isolated are [ZnCl(CHMTSC)]Cl and [Cd(NO3)(CHMTSC)]NO3, containing the protonated forms of the ligand, which have been characterised by X-ray crystallography, as has free CHMTSC. The kinetics of the reactions between CHMTSC and all the various metal salts have been determined by stopped-flow spectrophotometry. In all cases, the reactions are complete on the seconds timescale. The reactions exhibit a first-order dependence on the concentration of metal salt and a first-order dependence on the concentration of CHMTSC. The thermodynamic and kinetic factors influencing the protonation state of the coordinated thiosemicarbazone are discussed. PMID:19122915

  3. Linked strategy for the production of fuels via formose reaction

    PubMed Central

    Deng, Jin; Pan, Tao; Xu, Qing; Chen, Meng-Yuan; Zhang, Ying; Guo, Qing-Xiang; Fu, Yao

    2013-01-01

    Formose reaction converts formaldehyde to carbohydrates. We found that formose reaction can be used linking the biomass gasification with the aqueous-phase processing (APP) to produce liquid transportation fuel in three steps. First, formaldehyde from syn-gas was converted to triose. This was followed by aldol condensation and dehydration to 4-hydroxymethylfurfural (4-HMF). Finally, 4-HMF was hydrogenated to produce 2,4-dimethylfuran (2,4-DMF) or C9-C15 branched-chain alkanes as liquid transportation fuels. In the linked strategy, high energy-consuming pretreatment as well as expensive and polluting hydrolysis of biomass were omitted, but the high energy recovery of APP was inherited. In addition, the hexoketoses via formose reaction could be converted to HMFs directly without isomerization. A potential platform molecule 4-HMF was formed simultaneously in APP. PMID:23393625

  4. Linked strategy for the production of fuels via formose reaction.

    PubMed

    Deng, Jin; Pan, Tao; Xu, Qing; Chen, Meng-Yuan; Zhang, Ying; Guo, Qing-Xiang; Fu, Yao

    2013-01-01

    Formose reaction converts formaldehyde to carbohydrates. We found that formose reaction can be used linking the biomass gasification with the aqueous-phase processing (APP) to produce liquid transportation fuel in three steps. First, formaldehyde from syn-gas was converted to triose. This was followed by aldol condensation and dehydration to 4-hydroxymethylfurfural (4-HMF). Finally, 4-HMF was hydrogenated to produce 2,4-dimethylfuran (2,4-DMF) or C(9)-C(15) branched-chain alkanes as liquid transportation fuels. In the linked strategy, high energy-consuming pretreatment as well as expensive and polluting hydrolysis of biomass were omitted, but the high energy recovery of APP was inherited. In addition, the hexoketoses via formose reaction could be converted to HMFs directly without isomerization. A potential platform molecule 4-HMF was formed simultaneously in APP. PMID:23393625

  5. Comparison of Complementary Reactions in the Production of Mt

    SciTech Connect

    Nelson, Sarah; Gregorich, Kenneth; Dragojevic, Irena; Ellison, Paul; Garcia, Mitch Andre; Gates, Jacklyn; Stavsetra, Liv; Ali, Mazhar; Nitsche, Heino

    2009-01-21

    The new reaction 208Pb(59Co,n)266Mt was studied using the Berkeley Gas-filled Separator at the Lawrence Berkeley National Laboratory 88-Inch Cyclotron. A cross section of 7.7+5.2-3.3 pb was measured at a compound nucleus excitation energy of 14.9 MeV. The measured decay properties of 266Mt and its daughters correspond well with existing data. We compare this experimental result to transactinide compound nucleus formation model predictions, and the previously studied 209Bi(58Fe,n)266Mt reaction.

  6. Comparison of complementary reactions in the production of Mt

    SciTech Connect

    Nelson, S. L.; Dragojevic, I.; Ellison, P. A.; Garcia, M. A.; Gates, J. M.; Nitsche, H.; Gregorich, K. E.; Dvorak, J.; Stavsetra, L.; Ali, M. N.

    2009-02-15

    The new reaction {sup 208}Pb({sup 59}Co,n){sup 266}Mt was studied using the Berkeley Gas-filled Separator at the Lawrence Berkeley National Laboratory 88-Inch Cyclotron. A cross section of 7.7{sub -3.3}{sup +5.2} pb was measured at a compound nucleus excitation energy of 14.9 MeV. The measured decay properties of {sup 266}Mt and its daughters correspond well with existing data. We compare this experimental result to transactinide compound nucleus formation model predictions, and the previously studied {sup 209}Bi({sup 58}Fe,n){sup 266}Mt reaction.

  7. Utility of spectral measurements of secondary reaction products

    SciTech Connect

    Heidbrink, W.E.

    1986-02-01

    The spectra of 15 MeV protons and 14 MeV neutrons produced in the burnup of 0.8 MeV THe ions and 1 MeV tritons through the d(THe,p) and d(t,n) fusion reactions contain information on the velocity distributions of the energetic THe ions and tritons. 11 refs., 2 figs.

  8. Enhancing Research Productivity in Counseling Psychology: Reactions to Three Perspectives

    ERIC Educational Resources Information Center

    Betz, Nancy E.

    2005-01-01

    The present reaction responds to the three research-related core articles in the Scientific Forum of the May 2005 issue of "The Counseling Psychologist." I agree that too few of our studies are based on theories or models. Using the nomological network, I suggest how research ideas can more readily be depicted to allow model and theory testing. I…

  9. The Phase Behavior Effect on the Reaction Engineering of Transesterification Reactions and Reactor Design for Continuous Biodiesel Production

    NASA Astrophysics Data System (ADS)

    Csernica, Stephen N.

    transitions from two phases to a single phase, or pseudo-single phase. The transition to a single phase or pseudo-single phase is a function of the methanol content. Regardless, the maximum observed reaction rate occurs at the point of the phase transition, when the concentration of triglycerides in the methanol phase is largest. The phase transition occurs due to the accumulation of the primary product, biodiesel methyl esters. Through various experiments, it was determined that the rate of the triglyceride mass transfer into the methanol phase, as well as the solubility of triglycerides in methanol, increases with increasing methyl ester concentration. Thus, there exists some critical methyl ester concentration which favors the formation of a single or pseudo-single phase system. The effect of the by-product glycerol on the reaction kinetics was also investigated. It was determined that at low methanol to triglyceride molar ratios, glycerol acts to inhibit the reaction rate and limit the overall triglyceride conversion. This occurs because glycerol accumulates in the methanol phase, i.e. the primary reaction volume. When glycerol is at relatively high concentrations within the methanol phase, triglycerides become excluded from the reaction volume. This greatly reduces the reaction rate and limits the overall conversion. As the concentration of methanol is increased, glycerol becomes diluted and the inhibitory effects become dampened. Assuming pseudo-homogeneous phase behavior, a simple kinetic model incorporating the inhibitory effects of glycerol was proposed based on batch reactor data. The kinetic model was primarily used to theoretically compare the performance of different types of continuous flow reactors for continuous biodiesel production. It was determined that the inhibitory effects of glycerol result in the requirement of very large reactor volumes when using continuous stirred tank reactors (CSTR). The reactor volume can be greatly reduced using tubular style

  10. Effect of an allophanic soil on humification reactions between catechol and glycine: Spectroscopic investigations of reaction products

    NASA Astrophysics Data System (ADS)

    Fukushima, Masami; Miura, Akitaka; Sasaki, Masahide; Izumo, Kenji

    2009-01-01

    Adduction of amino acids to phenols is a possible humification reaction pathway [F.J. Stevenson, Humus Chemistry: Genesis, Composition, Reaction, second ed., Wiley, New York, 1994, pp. 188-211; M.C. Wang, P.M. Huang, Sci. Total Environ. 62 (1987) 435; M.C. Wang, P.M. Huang, Soil Sci. Soc. Am. J. 55 (1991) 1156; M.C. Wang, P.M. Huang, Geoderma 112 (2003) 31; M.C. Wang, P.M. Huang, Geoderma 124 (2005) 415]. To elucidate the reaction kinetics and products of abiotic humification, the effects of an allophanic soil on the adduction of amino acids to phenols were investigated using catechol (CT) and glycine (Gly) as a model phenol and amino acid, respectively. An aqueous solution containing CT and Gly (pH 7.0) in the presence of allophanic soil was incubated for 2 weeks, and the kinetics of the humification reactions were monitored by analysis of absorptivity at 600 nm ( E600). A mixture of CT and Gly in the absence of allophanic soil was used as a control. The E600 value increased markedly in the presence of allophanic soil. In addition, unreacted CT was detected in the control reaction mixture, but not in the allophane-containing reaction mixture. Under the sterilized conditions, absorbance at 600 nm for the control reaction mixture was significantly smaller than that for the allophanic soil-containing reaction mixture, which indicates there was no microbial participation during incubation. These results indicate that the allophanic soil effectively facilitated humification reactions between CT and Gly. The reaction mixtures were acidified and humic-like acid (HLA) was isolated as a precipitate. The elemental composition, acidic functional group contents, molecular weight, FT-IR, solid-state CP-MAS 13C NMR, and 1H NMR spectra of the purified HLAs were analyzed. The results of these analyses indicate that the nitrogen atom of Gly binds to the aromatic carbon of CT in the HLA products.

  11. Effects of hydrolysis and carbonization reactions on hydrochar production.

    PubMed

    Fakkaew, K; Koottatep, T; Polprasert, C

    2015-09-01

    Hydrothermal carbonization (HTC) is a thermal conversion process which converts wet biomass into hydrochar. In this study, a low-energy HTC process named "Two-stage HTC" comprising of hydrolysis and carbonization stages using faecal sludge as feedstock was developed and optimized. The experimental results indicated the optimum conditions of the two-stage HTC to be; hydrolysis temperature of 170 °C, hydrolysis reaction time of 155 min, carbonization temperature of 215 °C, and carbonization reaction time of 100 min. The hydrolysis reaction time and carbonization temperature had a statistically significant effect on energy content of the produced hydrochar. Energy input of the two-stage HTC was about 25% less than conventional HTC. Energy efficiency of the two-stage HTC for treating faecal sludge was higher than that of conventional HTC and other thermal conversion processes such as pyrolysis and gasification. The two-stage HTC could be considered as a potential technology for treating FS and producing hydrochar. PMID:26051497

  12. Origin of Nanobubbles Electrochemically Formed in a Magnetic Field: Ionic Vacancy Production in Electrode Reaction

    NASA Astrophysics Data System (ADS)

    Aogaki, Ryoichi; Sugiyama, Atsushi; Miura, Makoto; Oshikiri, Yoshinobu; Miura, Miki; Morimoto, Ryoichi; Takagi, Satoshi; Mogi, Iwao; Yamauchi, Yusuke

    2016-07-01

    As a process complementing conventional electrode reactions, ionic vacancy production in electrode reaction was theoretically examined; whether reaction is anodic or cathodic, based on the momentum conservation by Newton’s second law of motion, electron transfer necessarily leads to the emission of original embryo vacancies, and dielectric polarization endows to them the same electric charge as trans- ferred in the reaction. Then, the emitted embryo vacancies immediately receive the thermal relaxation of solution particles to develop steady-state vacancies. After the vacancy production, nanobubbles are created by the collision of the vacancies in a vertical magnetic field.

  13. Origin of Nanobubbles Electrochemically Formed in a Magnetic Field: Ionic Vacancy Production in Electrode Reaction

    PubMed Central

    Aogaki, Ryoichi; Sugiyama, Atsushi; Miura, Makoto; Oshikiri, Yoshinobu; Miura, Miki; Morimoto, Ryoichi; Takagi, Satoshi; Mogi, Iwao; Yamauchi, Yusuke

    2016-01-01

    As a process complementing conventional electrode reactions, ionic vacancy production in electrode reaction was theoretically examined; whether reaction is anodic or cathodic, based on the momentum conservation by Newton’s second law of motion, electron transfer necessarily leads to the emission of original embryo vacancies, and dielectric polarization endows to them the same electric charge as trans- ferred in the reaction. Then, the emitted embryo vacancies immediately receive the thermal relaxation of solution particles to develop steady-state vacancies. After the vacancy production, nanobubbles are created by the collision of the vacancies in a vertical magnetic field. PMID:27377532

  14. Origin of Nanobubbles Electrochemically Formed in a Magnetic Field: Ionic Vacancy Production in Electrode Reaction.

    PubMed

    Aogaki, Ryoichi; Sugiyama, Atsushi; Miura, Makoto; Oshikiri, Yoshinobu; Miura, Miki; Morimoto, Ryoichi; Takagi, Satoshi; Mogi, Iwao; Yamauchi, Yusuke

    2016-01-01

    As a process complementing conventional electrode reactions, ionic vacancy production in electrode reaction was theoretically examined; whether reaction is anodic or cathodic, based on the momentum conservation by Newton's second law of motion, electron transfer necessarily leads to the emission of original embryo vacancies, and dielectric polarization endows to them the same electric charge as trans- ferred in the reaction. Then, the emitted embryo vacancies immediately receive the thermal relaxation of solution particles to develop steady-state vacancies. After the vacancy production, nanobubbles are created by the collision of the vacancies in a vertical magnetic field. PMID:27377532

  15. 40 CFR 180.437 - Methyl 2-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-p-toluate and methyl 6-(4-isopropyl-4...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ...-imidazolin-2-yl)-p-toluate and methyl 6-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-m-toluate; tolerances... Tolerances § 180.437 Methyl 2-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-p-toluate and methyl 6-(4... for the combined residues of the herbicide methyl...

  16. The reaction of cobaloximes with hydrogen: Products and thermodynamics

    DOE PAGESBeta

    Estes, Deven P.; Grills, David C.; Norton, Jack R.

    2014-11-26

    In this study, a cobalt hydride has been proposed as an intermediate in many reactions of the Co(dmgBF₂)₂L₂ system, but its observation has proven difficult. We have observed the UV–vis spectra of Co(dmgBF₂)₂L₂ (1) in CH₃CN under hydrogen pressures up to 70 atm. A Co(I) compound (6), with an exchangeable proton, is eventually formed. We have determined the bond dissociation free energy and pKa of the new O–H bond in 6 to be 50.5 kcal/mol and 13.4, respectively, in CH₃CN, matching previous reports.

  17. Reaction kinetics and product distributions in photoelectrochemical cells

    SciTech Connect

    Koval, C.A.

    1992-01-01

    Hot electron reaction studies at p-InP/CH[sub 3]CN interface revealed essential/desirable features for redox systems used to investigate hot carriers in photoelectrocehmical cells. Reduction of dibromoethylbenzene (DBEB) in presence of metallocene couples is being studied using rotating rink disk electrodes of n-and p-InP disks and Pt rings. At highly doped p-InP electrodes, reduction of DBEB can be very efficient (>30%). A minielectrochemical cell was used to investigate electron transfer at nonilluminated n-WSe[sub 2]/dimethylferrocene[sup +/0] interfaces.

  18. Production of heavy actinides in incomplete fusion reactions

    NASA Astrophysics Data System (ADS)

    Antonenko, N. V.; Cherepanov, E. A.; Iljinov, A. S.; Mebel, M. V.

    1994-10-01

    We present preliminary results of calculations by the phenomenological model of the estimated yield of some heavy actinide isotopes. It is assumed that these isotopes are produced as a result of multinucleon transfers followed by neutrons and charged particle emission A.S. Iljinov and E.A. Cherepanov (1980). The yield P(sub Z, N)(E*) of primary excited actinides is found using the model of N.V. Antonenko and R.V. Jolos (1991). Absolute cross-sections for different binary reaction channels are obtained by summing the cross-sections for all subchannels with an appreciable yield according to J. Wilczynski et al. (1980).

  19. Process for chemical reaction of amino acids and amides yielding selective conversion products

    DOEpatents

    Holladay, Jonathan E.

    2006-05-23

    The invention relates to processes for converting amino acids and amides to desirable conversion products including pyrrolidines, pyrrolidinones, and other N-substituted products. L-glutamic acid and L-pyroglutamic acid provide general reaction pathways to numerous and valuable selective conversion products with varied potential industrial uses.

  20. Optical model methods of predicting nuclide production from spallation reactions

    NASA Technical Reports Server (NTRS)

    Ramsey, C. R.; Townsend, L. W.; Tripathi, R. K.; Cucinotta, F. A.; Wilson, J. W. (Principal Investigator)

    1998-01-01

    Quantum mechanical optical model methods for calculating isotope production cross sections from the spallation of heavy nuclei by high-energy protons are developed from a modified abrasion-ablation collision formalism. The abrasion step is treated quantum-mechanically as a knockout process which leaves the residual prefragment nucleus in an excited state. In ablation the prefragment deexcites to produce the final fragment. The excitation energies of the prefragments are estimated from a combination of liquid drop and frictional-spectator interaction considerations. Estimates of elemental and isotopic production cross sections are in good agreement with recently published cross section measurements.

  1. Design, synthesis, and pharmacological evaluation of JDTic analogs to examine the significance of the 3- and 4-methyl substituents.

    PubMed

    Carroll, F Ivy; Gichinga, Moses G; Kormos, Chad M; Maitra, Rangan; Runyon, Scott P; Thomas, James B; Mascarella, S Wayne; Decker, Ann M; Navarro, Hernán A

    2015-10-01

    The design and discovery of JDTic as a potent and selective kappa opioid receptor antagonist used the N-substituted trans-3,4-dimethyl-4-(3-hydroxyphenyl)piperidine pharmacophore as the lead structure. In order to determine if the 3-methyl or 4-methyl groups were necessary in JDTic and JDTic analogs for antagonistic activity, compounds 4a-c, and 4d-f which have either the 3-methyl or both the 3- and 4-methyl groups removed, respectively, from JDTic and analogs were synthesized and evaluated for their in vitro opioid receptor antagonist activities using a [(35)S]GTPγS binding assay. Other ADME properties were also assessed for selected compounds. These studies demonstrated that neither the 3-methyl or 3,4-dimethyl groups present in JDTic and analogs are required to produce potent and selective κ opioid receptor antagonists. PMID:26342544

  2. Miscible viscous fingering involving production of gel by chemical reactions

    NASA Astrophysics Data System (ADS)

    Nagatsu, Yuichiro; Hoshino, Kenichi

    2015-11-01

    We have experimentally investigated miscible viscous fingering with chemical reactions producing gel. Here, two systems were employed. In one system, sodium polyacrylate (SPA) solution and aluminum ion (Al3 +) solution were used as the more and less viscous liquids, respectively. In another system, SPA solution and ferric ion (Fe3 +) solution were used as the more and less viscous liquids, respectively. In the case of Al3 +, displacement efficiency was smaller than that in the non-reactive case, whereas in the case of Fe3 +, the displacement efficiency was larger. We consider that the difference in change of the patterns in the two systems will be caused by the difference in the properties of the gels. Therefore, we have measured the rheological properties of the gels by means of a rheometer. We discuss relationship between the VF patterns and the rheological measurement.

  3. 21 CFR 73.3127 - Vinyl alcohol/methyl methacrylate-dye reaction products.

    Code of Federal Regulations, 2013 CFR

    2013-04-01

    ... 21 Food and Drugs 1 2013-04-01 2013-04-01 false Vinyl alcohol/methyl methacrylate-dye reaction... Vinyl alcohol/methyl methacrylate-dye reaction products. (a) Identity. The color additives are formed by reacting the dyes, either alone or in combination, with a vinyl alcohol/methyl methacrylate copolymer,...

  4. 21 CFR 73.3127 - Vinyl alcohol/methyl methacrylate-dye reaction products.

    Code of Federal Regulations, 2012 CFR

    2012-04-01

    ... 21 Food and Drugs 1 2012-04-01 2012-04-01 false Vinyl alcohol/methyl methacrylate-dye reaction... Vinyl alcohol/methyl methacrylate-dye reaction products. (a) Identity. The color additives are formed by reacting the dyes, either alone or in combination, with a vinyl alcohol/methyl methacrylate copolymer,...

  5. 21 CFR 73.3127 - Vinyl alcohol/methyl methacrylate-dye reaction products.

    Code of Federal Regulations, 2011 CFR

    2011-04-01

    ... 21 Food and Drugs 1 2011-04-01 2011-04-01 false Vinyl alcohol/methyl methacrylate-dye reaction... Vinyl alcohol/methyl methacrylate-dye reaction products. (a) Identity. The color additives are formed by reacting the dyes, either alone or in combination, with a vinyl alcohol/methyl methacrylate copolymer,...

  6. CHROMATOGRAPHIC SEPARATION AND IDENTIFICATION OF PRODUCTS FROM THE REACTION OF DIMETHYLARSINIC ACID WITH HYDROGEN SULFIDE

    EPA Science Inventory

    The reaction of dimethylarsinic acid (DMAV) with hydrogen sulfide (H2S) is of biological significance and may be implicated in the overall toxicity and carcinogenicity of arsenic. The course of the reaction in aqueous phase was monitored and an initial product, dimethylthioarsin...

  7. Reactions between beta-lactoglobulin and genipin: kinetics and characterization of the products

    Technology Transfer Automated Retrieval System (TEKTRAN)

    In this paper, we present the first detailed report of the reaction kinetics studies and the characterization of the products from the endothermic reactions between beta-lactoglobulin and genipin. The effects of concentration, temperature, and pH were examined. In the temperature range studied, th...

  8. 21 CFR 73.3127 - Vinyl alcohol/methyl methacrylate-dye reaction products.

    Code of Federal Regulations, 2014 CFR

    2014-04-01

    ... 21 Food and Drugs 1 2014-04-01 2014-04-01 false Vinyl alcohol/methyl methacrylate-dye reaction... Vinyl alcohol/methyl methacrylate-dye reaction products. (a) Identity. The color additives are formed by reacting the dyes, either alone or in combination, with a vinyl alcohol/methyl methacrylate copolymer,...

  9. PRODUCTION OF ORGANIC NITRATES FROM HYDROXYL AND NITRATE RADICAL REACTION WITH PROPYLENE

    EPA Science Inventory

    Measurements of the gas-phase production rates of alpha-nitratoacetone, propylene glycol dinitrate, 2-hydroxy propyl nitrate, and 2-nitrato propyl alcohol (2-NPA) in a C3H6/N2O5/air dark reaction and a C3H6/NOX/air irradiation are reported. The probable operative reaction mechani...

  10. 40 CFR 721.10662 - Acetaldehyde, substituted-, reaction products with 2-butyne-1, 4-diol (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...-, reaction products with 2-butyne-1, 4-diol (generic). (a) Chemical substance and significant new uses... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Acetaldehyde, substituted-, reaction... ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  11. 40 CFR 721.4385 - Hydrofluoric acid, reaction products with heptane.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4385 Hydrofluoric acid, reaction products with heptane. (a) Chemical... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Hydrofluoric acid, reaction...

  12. Mapping Students' Conceptual Modes When Thinking about Chemical Reactions Used to Make a Desired Product

    ERIC Educational Resources Information Center

    Weinrich, M. L.; Talanquer, V.

    2015-01-01

    The central goal of this qualitative research study was to uncover major implicit assumptions that students with different levels of training in the discipline apply when thinking and making decisions about chemical reactions used to make a desired product. In particular, we elicited different ways of conceptualizing why chemical reactions happen…

  13. 40 CFR 721.10662 - Acetaldehyde, substituted-, reaction products with 2-butyne-1, 4-diol (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...-, reaction products with 2-butyne-1, 4-diol (generic). (a) Chemical substance and significant new uses... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Acetaldehyde, substituted-, reaction... ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  14. 40 CFR 721.4461 - Hydrofluoric acid, reaction products with octane (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4461 Hydrofluoric acid, reaction products with octane... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Hydrofluoric acid, reaction...

  15. 40 CFR 721.10240 - Olefinic carbocycle, reaction products with alkoxysilane (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10240 Olefinic carbocycle, reaction products with... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Olefinic carbocycle, reaction...

  16. 40 CFR 721.4385 - Hydrofluoric acid, reaction products with heptane.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4385 Hydrofluoric acid, reaction products with heptane. (a) Chemical... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Hydrofluoric acid, reaction...

  17. 40 CFR 721.4461 - Hydrofluoric acid, reaction products with octane (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4461 Hydrofluoric acid, reaction products with octane... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Hydrofluoric acid, reaction...

  18. 40 CFR 721.4385 - Hydrofluoric acid, reaction products with heptane.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4385 Hydrofluoric acid, reaction products with heptane. (a) Chemical... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Hydrofluoric acid, reaction...

  19. 40 CFR 721.4461 - Hydrofluoric acid, reaction products with octane (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4461 Hydrofluoric acid, reaction products with octane... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Hydrofluoric acid, reaction...

  20. 40 CFR 721.4385 - Hydrofluoric acid, reaction products with heptane.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4385 Hydrofluoric acid, reaction products with heptane. (a) Chemical... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Hydrofluoric acid, reaction...

  1. 40 CFR 721.4461 - Hydrofluoric acid, reaction products with octane (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4461 Hydrofluoric acid, reaction products with octane... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Hydrofluoric acid, reaction...

  2. 40 CFR 721.9460 - Tall oil fatty acids, reaction products with polyamines, alkyl substituted.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9460 Tall oil fatty acids, reaction... reporting. (1) The chemical substance identified generically as tall oil fatty acids, reaction products with... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Tall oil fatty acids,...

  3. 40 CFR 721.10240 - Olefinic carbocycle, reaction products with alkoxysilane (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10240 Olefinic carbocycle, reaction products with... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Olefinic carbocycle, reaction...

  4. 40 CFR 721.9460 - Tall oil fatty acids, reaction products with polyamines, alkyl substituted.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9460 Tall oil fatty acids, reaction... reporting. (1) The chemical substance identified generically as tall oil fatty acids, reaction products with... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Tall oil fatty acids,...

  5. 40 CFR 721.10240 - Olefinic carbocycle, reaction products with alkoxysilane (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10240 Olefinic carbocycle, reaction products with... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Olefinic carbocycle, reaction...

  6. 40 CFR 721.9460 - Tall oil fatty acids, reaction products with polyamines, alkyl substituted.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9460 Tall oil fatty acids, reaction... reporting. (1) The chemical substance identified generically as tall oil fatty acids, reaction products with... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Tall oil fatty acids,...

  7. 40 CFR 721.9460 - Tall oil fatty acids, reaction products with polyamines, alkyl substituted.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9460 Tall oil fatty acids, reaction... reporting. (1) The chemical substance identified generically as tall oil fatty acids, reaction products with... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Tall oil fatty acids,...

  8. 40 CFR 721.4461 - Hydrofluoric acid, reaction products with octane (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4461 Hydrofluoric acid, reaction products with octane... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Hydrofluoric acid, reaction...

  9. 40 CFR 721.4385 - Hydrofluoric acid, reaction products with heptane.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.4385 Hydrofluoric acid, reaction products with heptane. (a) Chemical... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Hydrofluoric acid, reaction...

  10. 40 CFR 721.9460 - Tall oil fatty acids, reaction products with polyamines, alkyl substituted.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9460 Tall oil fatty acids, reaction... reporting. (1) The chemical substance identified generically as tall oil fatty acids, reaction products with... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Tall oil fatty acids,...

  11. Structures of the reaction products of the AZADO radical with TCNQF4 or thiourea

    PubMed Central

    Suzuki, Hideto; Kawahara, Yuta; Akutsu, Hiroki; Yamada, Jun-ichi

    2013-01-01

    Summary While an addition product was formed by the reaction of AZADO (2-azaadamantane N-oxyl) with TCNQF4 (2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane), the reaction of AZADO with thiourea provided an inclusion compound, in which AZADO molecules are incorporated in cylindrical channels formed by thiourea molecules. PMID:23946847

  12. 21 CFR 73.3127 - Vinyl alcohol/methyl methacrylate-dye reaction products.

    Code of Federal Regulations, 2010 CFR

    2010-04-01

    ... 21 Food and Drugs 1 2010-04-01 2010-04-01 false Vinyl alcohol/methyl methacrylate-dye reaction... Vinyl alcohol/methyl methacrylate-dye reaction products. (a) Identity. The color additives are formed by reacting the dyes, either alone or in combination, with a vinyl alcohol/methyl methacrylate copolymer,...

  13. Use of Moessbauer spectroscopy to study reaction products of polyphenols and iron compounds

    SciTech Connect

    Gust, J. ); Suwalski, J. )

    1994-05-01

    Moessbauer spectroscopy was used to study parameters of the reaction products of iron compounds (Fe[sup III]) and polyphenols with hydroxyl (OH) groups in ortho positions. Polyphenols used in the reaction were catechol, pyrogallol, gallic acid, and oak tannin. The Fe-containing compounds were hydrated ferric sulfate (Fe[sub 2][SO[sub 4

  14. NMR Studies of Biomass and its Reaction Products

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Biomass refers to biological material derived from living or recently living organisms, such as wood, agricultural products and wastes, and alcohol fuels. An increasingly popular R&D approach is to convert biomass into industrial polymers or chemicals. NMR is an excellent technique for the character...

  15. REACTION PRODUCTS FROM THE CHLORINATION OF SEAWATER. CHAPTER 34

    EPA Science Inventory

    Much of the present information on the products formed when seawater is chlorinated is based on observations of laboratory experiments in which chlorine was added to seawater to stimulate conditions of electricity generating plants. Results are reported for a field study at the P...

  16. Properties of some ionic liquids based on1-methyl-3-octylimidazolium and 4-methyl-N-butylpyridinium cations.

    SciTech Connect

    Papaiconomou, Nicolas; Yakelis, Neal; Salminen, Justin; Bergman,Robert; Prausnitz, John M.

    2005-09-29

    Syntheses are reported for ionic liquids containing 1-methyl-3octylimidazolium and 4-methyl-N-butylpyridinium cations, and trifluoromethansulfonate, dicyanamide, bis(trifluoromethylsulfonyl)imide, and nonafluorobutanesulfonate anions. Densities, melting points and glass transition points, solubility in water as well as polarities have been measured. Ionic liquids based on pyridinium cations exhibit higher melting points, lower solubility in water, and higher polarity than those based on imidazolium cations.

  17. Measuring protection of aromatic wine thiols from oxidation by competitive reactions vs wine preservatives with ortho-quinones.

    PubMed

    Nikolantonaki, Maria; Magiatis, Prokopios; Waterhouse, Andrew L

    2014-11-15

    Quinones are central intermediates in wine oxidation that can degrade the quality of wine by reactions with varietal thiols, such as 3-sulfanylhexanol, decreasing desirable aroma. Protection by wine preservatives (sulphur dioxide, glutathione, ascorbic acid and model tannin, phloroglucinol) was assessed by competitive sacrificial reactions with 4-methyl-1,2-benzoquinone, quantifying products and ratios by HPLC-UV-MS. Regioselectivity was assessed by product isolation and identification by NMR spectroscopy. Nucleophilic addition reactions compete with two electron reduction of quinones by sulphur dioxide or ascorbic acid, and both routes serve as effective quenching pathways, but minor secondary products from coupled redox reactions between the products and reactants are also observed. The wine preservatives were all highly reactive and thus all very protective against 3-sulfanylhexanol loss to the quinone, but showed only additive antioxidant effects. Confirmation of these reaction rates and pathways in wine is needed to assess the actual protective action of each tested preservative. PMID:24912696

  18. Liquid composition having ammonia borane and decomposing to form hydrogen and liquid reaction product

    DOEpatents

    Davis, Benjamin L; Rekken, Brian D

    2014-04-01

    Liquid compositions of ammonia borane and a suitably chosen amine borane material were prepared and subjected to conditions suitable for their thermal decomposition in a closed system that resulted in hydrogen and a liquid reaction product.

  19. Diesel lubricant composition containing 5-amino-triazole-succinic anhydride reaction product

    SciTech Connect

    Sung, R.L.; Zoleski, B.H.

    1981-03-17

    A diesel crankcase lubricant is described. It contains a lubricating oil base and the reaction product of a hydrocarbyl succinic anhydride. The hydrocarbyl radical has from 12 to 30 carbon atoms and 5-amino-triazole.

  20. Production of Printed Indexes of Chemical Reactions. I. Analysis of Functional Group Interconversions

    ERIC Educational Resources Information Center

    Clinging, R.; Lynch, M. F.

    1973-01-01

    A program is described which identifies functional group interconversion reactions, hydrogenations, and dehydrogenations in a data base containing structures encoded as Wiswesser Line Notations. Production of the data base is briefly described. (17 references) (Authors)

  1. Dynamical coupled-channels study of meson production reactions from EBAC@Jlab

    SciTech Connect

    Hiroyuki Kamano

    2011-10-01

    We present the current status of a combined and simultaneous analysis of meson production reactions based on a dynamical coupled-channels (DCC) model, which is conducted at Excited Baryon Analysis Center (EBAC) of Jefferson Lab.

  2. Dynamical coupled-channels study of meson production reactions from EBACatJLab

    SciTech Connect

    Kamano, Hiroyuki

    2011-10-24

    We present the current status of a combined and simultaneous analysis of meson production reactions based on a dynamical coupled-channels (DCC) model, which is conducted at Excited Baryon Analysis Center (EBAC) of Jefferson Lab.

  3. Extraction of Nucleon Resonances From Global Analysis of Meson Production Reactions at EBAC

    SciTech Connect

    Hiroyuki Kamano

    2011-10-01

    We report the current status of exploring the dynamical aspect of the excited nucleon states through the comprehensive coupled-channels analysis of meson production reactions at the Excited Baryon Analysis Center of Jefferson Lab.

  4. (1-Butyl-4-methyl-pyridinium)[Cu(SCN)2]: a coordination polymer and ionic liquid.

    PubMed

    Spielberg, Eike T; Edengeiser, Eugen; Mallick, Bert; Havenith, Martina; Mudring, Anja-Verena

    2014-04-25

    The compound (C4C1py)[Cu(SCN)2], (C4C1py = 1-Butyl-4-methyl-pyridinium), which can be obtained from CuSCN and the ionic liquid (C4C1py)(SCN), turns out to be a new organic-inorganic hybrid material as it qualifies both, as a coordination polymer and an ionic liquid. It features linked [Cu(SCN)2](-) units, in which the thiocyanates bridge the copper ions in a μ1,3-fashion. The resulting one-dimensional chains run along the a axis, separated by the C4C1py counterions. Powder X-ray diffraction not only confirms the single-crystal X-ray structure solution but proves the reformation of the coordination polymer from an isotropic melt. However, the materials shows a complex thermal behavior often encountered for ionic liquids such as a strong tendency to form a supercooled melt. At a relatively high cooling rate, glass formation is observed. When heating this melt in differential scanning calorimetry (DSC) and temperature-dependent polarizing optical microscopy (POM), investigations reveal the existence of a less thermodynamically stable crystalline polymorph. Raman measurements conducted at 10 and 100 °C point towards the formation of polyanionic chain fragments in the melt. Solid-state UV/Vis spectroscopy shows a broad absorption band around 18,870 cm(-1) (530 nm) and another strong one below 20,000 cm(-1) (<500 nm). The latter is attributed to the d(Cu(I))→π*(SCN)-MLCT (metal-to-ligand charge transfer) transition within the coordination polymer yielding an energy gap of 2.4 eV. At room temperature and upon irradiation with UV light, the material shows a weak fluorescence band at 15,870 cm(-1) (630 nm) with a quantum efficiency of 0.90(2) % and a lifetime of 131(2) ns. Upon lowering the temperature, the luminescence intensity strongly increases. Simultaneously, the band around 450 nm in the excitation spectrum decreases. PMID:24644064

  5. Counteracting H3K4 methylation modulators Set1 and Jhd2 co-regulate chromatin dynamics and gene transcription.

    PubMed

    Ramakrishnan, Saravanan; Pokhrel, Srijana; Palani, Sowmiya; Pflueger, Christian; Parnell, Timothy J; Cairns, Bradley R; Bhaskara, Srividya; Chandrasekharan, Mahesh B

    2016-01-01

    Histone H3K4 methylation is connected to gene transcription from yeast to humans, but its mechanistic roles in transcription and chromatin dynamics remain poorly understood. We investigated the functions for Set1 and Jhd2, the sole H3K4 methyltransferase and H3K4 demethylase, respectively, in S. cerevisiae. Here, we show that Set1 and Jhd2 predominantly co-regulate genome-wide transcription. We find combined activities of Set1 and Jhd2 via H3K4 methylation contribute to positive or negative transcriptional regulation. Providing mechanistic insights, our data reveal that Set1 and Jhd2 together control nucleosomal turnover and occupancy during transcriptional co-regulation. Moreover, we find a genome-wide co-regulation of chromatin structure by Set1 and Jhd2 at different groups of transcriptionally active or inactive genes and at different regions within yeast genes. Overall, our study puts forth a model wherein combined actions of Set1 and Jhd2 via modulating H3K4 methylation-demethylation together control chromatin dynamics during various facets of transcriptional regulation. PMID:27325136

  6. Dynamical Coupled-Channel Model of Meson Production Reactions in the Nucleon Resonance Region

    SciTech Connect

    T.-S. H. Lee; A. Matsuyama; T. Sato

    2006-11-15

    A dynamical coupled-channel model is presented for investigating the nucleon resonances (N*) in the meson production reactions induced by pions and photons. Our objective is to extract the N* parameters and to investigate the meson production reaction mechanisms for mapping out the quark-gluon substructure of N* from the data. The model is based on an energy-independent Hamiltonian which is derived from a set of Lagrangians by using a unitary transformation method.

  7. Enzymatic browning reactions in apple and apple products.

    PubMed

    Nicolas, J J; Richard-Forget, F C; Goupy, P M; Amiot, M J; Aubert, S Y

    1994-01-01

    This review examines the parameters of enzymatic browning in apple and apple products that is, phenolic compounds, polyphenoloxidases, and other factors (ascorbic acid and peroxidases), both qualitatively and quantitatively. Then the relationships between intensity of browning and the browning parameters are discussed, including a paragraph on the methods used for browning evaluation. Finally, the different methods for the control of browning are presented. PMID:8011143

  8. 40 CFR 721.9280 - Reaction product of ethoxylated fatty acid oils and a phenolic pentaerythritol tetraester.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9280 Reaction product of... new uses subject to reporting. (1) The chemical substance identified generically as a reaction product... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of ethoxylated...

  9. 40 CFR 721.9280 - Reaction product of ethoxylated fatty acid oils and a phenolic pentaerythritol tetraester.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9280 Reaction product of... new uses subject to reporting. (1) The chemical substance identified generically as a reaction product... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of ethoxylated...

  10. 40 CFR 721.9280 - Reaction product of ethoxylated fatty acid oils and a phenolic pentaerythritol tetraester.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9280 Reaction product of... new uses subject to reporting. (1) The chemical substance identified generically as a reaction product... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of ethoxylated...

  11. 40 CFR 721.9280 - Reaction product of ethoxylated fatty acid oils and a phenolic pentaerythritol tetraester.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9280 Reaction product of... new uses subject to reporting. (1) The chemical substance identified generically as a reaction product... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of ethoxylated...

  12. 40 CFR 721.9280 - Reaction product of ethoxylated fatty acid oils and a phenolic pentaerythritol tetraester.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9280 Reaction product of... new uses subject to reporting. (1) The chemical substance identified generically as a reaction product... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of ethoxylated...

  13. 40 CFR 721.5560 - Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz[c...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz oxaphosphorin-6-oxide. 721.5560 Section 721... Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz oxaphosphorin-6... identified as formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with...

  14. 40 CFR 721.5560 - Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz[c...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz oxaphosphorin-6-oxide. 721.5560 Section 721... Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz oxaphosphorin-6... identified as formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with...

  15. Effect of Maillard reaction products on oxidation products in ground chicken breast.

    PubMed

    Miranda, L T; Rakovski, C; Were, L M

    2012-02-01

    Three amino acid-sugar solutions were adjusted to pH 8.0, heated and lyophilized prior to addition to ground chicken breast (GCB). GCB with no additives, GCB with 0.01% BHT, GCB with 0.1 or 0.2mg/g glucose heated with arginine, valine, or histidine were prepared. Thiobarbituric acid reactive substances (TBARS), volatiles determined by gas chromatography, and Hunter L*, a* and b* values were monitored over nine days. Multiple linear regression models were used to determine the effects of the studied factors on the corresponding outcome variables. a* values of GCB ranged from 1.60 to 4.90 over nine days of storage. While Maillard reaction products (MRP) lowered oxidation compared to control, no significant difference in TBARS between MRP solutions heated for 8 or 24h was found. Further, 0.1mg/g heated glucose-valine mixture decreased aldehydes up to 72.87%. Therefore, shelf-life of GCB could be extended using 0.1 or 0.2mg/g MRP. PMID:21871740

  16. The Phase Behavior Effect on the Reaction Engineering of Transesterification Reactions and Reactor Design for Continuous Biodiesel Production

    NASA Astrophysics Data System (ADS)

    Csernica, Stephen N.

    transitions from two phases to a single phase, or pseudo-single phase. The transition to a single phase or pseudo-single phase is a function of the methanol content. Regardless, the maximum observed reaction rate occurs at the point of the phase transition, when the concentration of triglycerides in the methanol phase is largest. The phase transition occurs due to the accumulation of the primary product, biodiesel methyl esters. Through various experiments, it was determined that the rate of the triglyceride mass transfer into the methanol phase, as well as the solubility of triglycerides in methanol, increases with increasing methyl ester concentration. Thus, there exists some critical methyl ester concentration which favors the formation of a single or pseudo-single phase system. The effect of the by-product glycerol on the reaction kinetics was also investigated. It was determined that at low methanol to triglyceride molar ratios, glycerol acts to inhibit the reaction rate and limit the overall triglyceride conversion. This occurs because glycerol accumulates in the methanol phase, i.e. the primary reaction volume. When glycerol is at relatively high concentrations within the methanol phase, triglycerides become excluded from the reaction volume. This greatly reduces the reaction rate and limits the overall conversion. As the concentration of methanol is increased, glycerol becomes diluted and the inhibitory effects become dampened. Assuming pseudo-homogeneous phase behavior, a simple kinetic model incorporating the inhibitory effects of glycerol was proposed based on batch reactor data. The kinetic model was primarily used to theoretically compare the performance of different types of continuous flow reactors for continuous biodiesel production. It was determined that the inhibitory effects of glycerol result in the requirement of very large reactor volumes when using continuous stirred tank reactors (CSTR). The reactor volume can be greatly reduced using tubular style

  17. KDM5B focuses H3K4 methylation near promoters and enhancers during embryonic stem cell self-renewal and differentiation

    PubMed Central

    2014-01-01

    Background Pluripotency of embryonic stem (ES) cells is controlled in part by chromatin-modifying factors that regulate histone H3 lysine 4 (H3K4) methylation. However, it remains unclear how H3K4 demethylation contributes to ES cell function. Results Here, we show that KDM5B, which demethylates lysine 4 of histone H3, co-localizes with H3K4me3 near promoters and enhancers of active genes in ES cells; its depletion leads to spreading of H3K4 methylation into gene bodies and enhancer shores, indicating that KDM5B functions to focus H3K4 methylation at promoters and enhancers. Spreading of H3K4 methylation to gene bodies and enhancer shores is linked to defects in gene expression programs and enhancer activity, respectively, during self-renewal and differentiation of KDM5B-depleted ES cells. KDM5B critically regulates H3K4 methylation at bivalent genes during differentiation in the absence of LIF or Oct4. We also show that KDM5B and LSD1, another H3K4 demethylase, co-regulate H3K4 methylation at active promoters but they retain distinct roles in demethylating gene body regions and bivalent genes. Conclusions Our results provide global and functional insight into the role of KDM5B in regulating H3K4 methylation marks near promoters, gene bodies, and enhancers in ES cells and during differentiation. PMID:24495580

  18. Investigation of photochemical reaction products of glucose formed during direct UV detection in CE.

    PubMed

    Schmid, Thomas; Himmelsbach, Markus; Buchberger, Wolfgang W

    2016-04-01

    In CE, saccharides are accessible to direct UV detection due to a photochemical reaction in the detection window of the separation capillary resulting in the formation of UV absorbing substances. Employing a CE method that allows long in-capillary irradiation with subsequent UV and MS detection, the present study could identify several reaction products of glucose. Among these were UV absorbing substances so far unknown to be formed during direct UV detection with the chemical formulas C4 H6 O2 , C5 H6 O4 , C5 H8 O3, and C6 H8 O5 . Investigations of the impact of the irradiation time revealed differences between these reaction products suggesting differing reaction mechanisms especially for the smallest products. More detailed information could be obtained by experiments with isotope-labeled substrates performed to determine the parts of glucose that are converted to the particular reaction products. In addition, structural formulas for the reaction products were suggested based on HPLC-MS/MS measurements of off-line irradiated glucose solutions which revealed the existence of functional groups such as carboxylic acid or aldehyde groups. PMID:26257208

  19. Reaction Mechanism and Product Branching Ratios of the CH + C3H6 Reaction: A Theoretical Study.

    PubMed

    Ribeiro, Joao Marcelo; Mebel, Alexander M

    2016-03-24

    The mechanism of CH(X(2)Π) reaction with propene has been studied with ab initio CCSD(T)-F12/CBS//B3LYP/6-311G(d,p) calculations of the C4H7 potential energy surface and RRKM/master equation calculations of unimolecular rate constants for the various isomerization and dissociation steps available to the C4H7 radicals. Product branching ratios were calculated and were found to strongly depend on the initial chemically activated C4H7 complex formed in a barrierless entrance channel. If the reaction is initiated via either CH addition to the double bond in propene or CH insertions into the terminal sp(2) C-H or single C-C bonds, then 1,3-butadiene + H are predicted to be the dominant products, ethene + C2H3 radical are minor but non-negligible products, and a small amount of 1,2-butadiene + H is also produced. The reaction then proceeds through a key CH3CHCH(•)CH2 intermediate, which loses an H atom to form either 1,3- or 1,2-butadiene or isomerizes to (•)CH2CH2CHCH2 and then dissociates to ethene + C2H3 radical. If CH inserts into a C-H bond in the CH3 group the (•)CH2CH2CHCH2 complex is formed directly and then the major reaction products are predicted to be ethene + C2H3 radical and 1,3-butadiene + H. Finally, if CH inserts into the middle sp(2) C-H bond, a branched CH3C((•)CH2)CH2 complex is produced, which predominantly decomposes to allene + CH3 radical. A comparison of the calculated reaction mechanism with available experimental data indicates that the CH addition entrance channel is favorable, in which case the computed branching ratios are in agreement with the experimental result of Loison and Bergeat, who measured the H elimination branching ratio of 78 ± 10%. However, the computed branching ratios quantitatively disagree with the experimental data by Trevitt et al., who observed a nearly 100% yield of the C4H6 + H products and also larger yields of 1,2-butadiene and 1-butyne than the calculations predict. The deviation of the theoretical results

  20. One pion production in neutrino reactions: Including nonresonant background

    SciTech Connect

    Lalakulich, O.; Leitner, T.; Buss, O.; Mosel, U.

    2010-11-01

    We investigate neutrino-induced one pion production on nucleons. The elementary neutrino-nucleon cross section is calculated as the sum of the leading Delta pole diagram and several background diagrams obtained within the nonlinear sigma model. This approach does not introduce any new adjustable parameters, which allows unambiguous predictions for the observables. Considering electroproduction experiments as benchmark, the model is shown to be applicable up to pion-nucleon invariant mass W<1.4 GeV and provides a good accuracy. With respect to the total one pion cross section, the model predicts the background at the level of 10% for the p{pi}{sup +}, 30% for p{pi}{sup 0}, and 50% for n{pi}{sup +} final states. The results are compared with experimental data for various differential cross sections. Distributions with respect to muon-nucleon and muon-pion invariant masses are presented for the first time. The model describes the data quite well, with the discrepancies being of the same order as those between different data sets.

  1. Limonene ozonolysis in the presence of nitric oxide: Gas-phase reaction products and yields

    NASA Astrophysics Data System (ADS)

    Ham, Jason E.; Harrison, Joel C.; Jackson, Stephen R.; Wells, J. R.

    2016-05-01

    The reaction products from limonene ozonolysis were investigated using the new carbonyl derivatization agent, O-tert-butylhydroxylamine hydrochloride (TBOX). With ozone (O3) as the limiting reagent, five carbonyl compounds were detected. The yields of the carbonyl compounds are discussed with and without the presence of a hydroxyl radical (OHrad) scavenger, giving insight into the influence secondary OH radicals have on limonene ozonolysis products. The observed reaction product yields for limonaketone (LimaKet), 7-hydroxyl-6-oxo-3-(prop-1-en-2-yl)heptanal (7H6O), and 2-acetyl-5-oxohexanal (2A5O) were unchanged suggesting OHrad generated by the limonene + O3 reaction does not contribute to their formation. The molar yields of 3-isopropenyl-6-oxo-heptanal (IPOH) and 3-acetyl-6-oxoheptanal (3A6O) decreased by 68% and >95%; respectively, when OHrad was removed. This suggests that OHrad radicals significantly impact the formation of these products. Nitric oxide (NO) did not significantly affect the molar yields of limonaketone or IPOH. However, NO (20 ppb) considerably decreased the molar reaction product yields of 7H6O (62%), 2A5O (63%), and 3A6O (47%), suggesting NO reacted with peroxyl intermediates, generated during limonene ozonolysis, to form other carbonyls (not detected) or organic nitrates. These studies give insight into the transformation of limonene and its reaction products that can lead to indoor exposures.

  2. Limonene ozonolysis in the presence of nitric oxide: Gas-phase reaction products and yields

    PubMed Central

    Ham, Jason E.; Harrison, Joel C.; Jackson, Stephen R.; Wells, J.R.

    2016-01-01

    The reaction products from limonene ozonolysis were investigated using the new carbonyl derivatization agent, O-tert-butylhydroxylamine hydrochloride (TBOX). With ozone (O3) as the limiting reagent, five carbonyl compounds were detected. The yields of the carbonyl compounds are discussed with and without the presence of a hydroxyl radical (OH•) scavenger, giving insight into the influence secondary OH radicals have on limonene ozonolysis products. The observed reaction product yields for limonaketone (LimaKet), 7-hydroxyl-6-oxo-3-(prop-1-en-2-yl)heptanal (7H6O), and 2-acetyl-5-oxohexanal (2A5O) were unchanged suggesting OH• generated by the limonene + O3 reaction does not contribute to their formation. The molar yields of 3-isopropenyl-6-oxo-heptanal (IPOH) and 3-acetyl-6-oxoheptanal (3A6O) decreased by 68% and >95%; respectively, when OH• was removed. This suggests that OH• radicals significantly impact the formation of these products. Nitric oxide (NO) did not significantly affect the molar yields of limonaketone or IPOH. However, NO (20 ppb) considerably decreased the molar reaction product yields of 7H6O (62%), 2A5O (63%), and 3A6O (47%), suggesting NO reacted with peroxyl intermediates, generated during limonene ozonolysis, to form other carbonyls (not detected) or organic nitrates. These studies give insight into the transformation of limonene and its reaction products that can lead to indoor exposures. PMID:27346977

  3. IN VIVO FORMATION OF HALOGENATED REACTION PRODUCTS FOLLOWING PERORAL SODIUM HYPOCHLORITE

    EPA Science Inventory

    To date the principal concern of the disinfection of potable water has centered on the formation of halogenated organic reaction products and the adverse health effects that these products may have. However, an additional area for concern relating to water disinfection is the pot...

  4. Maillard reaction products of rice protein hydrolysates with mono-, oligo- and polysaccharides

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Rice protein, a byproduct of rice syrup production, is abundant but, its lack of functionality prevents its wide use as a food ingredient. Maillard reaction products of (MRPs) hydrolysates from the limited hydrolysis of rice protein (LHRP) and various mono-, oligo- and polysaccharides were evaluat...

  5. An Upstream By-product from Ester Activation via NHC-Catalysis Catalyzes Downstream Sulfonyl Migration Reaction.

    PubMed

    Han, Runfeng; He, Liwenze; Liu, Lin; Xie, Xingang; She, Xuegong

    2016-01-01

    A sequential reaction combining N-heterocyclic carbene (NHC) and N-hydroxyphthalimide (NHPI) catalysis allowed for the upstream by-product NHPI, which was generated in the NHC-catalyzed cycloaddition reaction, to act as the catalyst for a downstream nitrogen-to-carbon sulfonyl migration reaction. Enantiomeric excess of the major product in the cycloaddition reaction remained intact in the follow-up sulfonyl migration reaction. PMID:26522328

  6. Reaction Product Identification in Extreme Chemical Environments by Broadband Rotational Spectroscopy

    NASA Astrophysics Data System (ADS)

    Pate, Brooks

    Molecular rotational spectroscopy has several advantages for detection of reaction intermediates and products under extreme laboratory conditions. Rotational spectroscopy has high sensitivity to the molecular structure and provides high spectral resolution in low pressure environments. Furthermore, quantum chemistry provides accurate estimates of the spectroscopic parameters. As a result, rotational spectroscopy can identify molecular species in complex reaction mixtures without the need for chromatographic separation and without the need for a previously recorded ``library spectrum'' of the molecule. The application of chirped pulse Fourier transform rotational spectroscopy methods for the identification of molecules of astrochemical interest formed in pulsed discharge sources will be described including recent advances for high-throughput mm-wave spectroscopy. The set of reaction products created in the experiment can provide insight into the reaction mechanism. Reactions involving the CN radical will be discussed. These reactions can be barrierless making them candidates for interstellar gas reactions. The possibility that interstellar cyanomethanimine is produced by gas phase radical-neutral reactions instead of surface chemistry on grain-supported ices will be discussed using recent spatially resolved chemical images in Sagittarius B2 observed with the Jansky Very Large Array. This work supported by NSF CHE 1213200.

  7. Aqueous Phase Photo-Oxidation of Succinic Acid: Changes in Hygroscopic Properties and Reaction Products

    NASA Astrophysics Data System (ADS)

    Hudson, P. K.; Ninokawa, A.; Hofstra, J.; de Lijser, P.

    2013-12-01

    Atmospheric aerosol particles have been identified as important factors in understanding climate change. The extent to which aerosols affect climate is determined, in part, by hygroscopic properties which can change as a result of atmospheric processing. Dicarboxylic acids, components of atmospheric aerosol, have a wide range of hygroscopic properties and can undergo oxidation and photolysis reactions in the atmosphere. In this study, the hygroscopic properties of succinic acid aerosol, a non-hygroscopic four carbon dicarboxylic acid, were measured with a humidified tandem differential mobility analyzer (HTDMA) and compared to reaction products resulting from the aqueous phase photo-oxidation reaction of hydrogen peroxide and succinic acid. Reaction products were determined and quantified using gas chromatography-flame ionization detection (GC-FID) and GC-mass spectrometry (GC-MS) as a function of hydrogen peroxide:succinic acid concentration ratio and photolysis time. Although reaction products include larger non-hygroscopic dicarboxylic acids (e.g. adipic acid) and smaller hygroscopic dicarboxylic acids (e.g. malonic and oxalic acids), comparison of hygroscopic growth curves to Zdanovskii-Stokes-Robinson (ZSR) predictions suggests that the hygroscopic properties of many of the product mixtures are largely independent of the hygroscopicity of the individual components. This study provides a framework for future investigations to fully understand and predict the role of chemical reactions in altering atmospheric conditions that affect climate.

  8. Biodiesel production from integration between reaction and separation system: reactive distillation process.

    PubMed

    da Silva, Nívea de Lima; Santander, Carlos Mario Garcia; Batistella, César Benedito; Filho, Rubens Maciel; Maciel, Maria Regina Wolf

    2010-05-01

    Biodiesel is a clean burning fuel derived from a renewable feedstock such as vegetable oil or animal fat. It is biodegradable, non-inflammable, non-toxic, and produces lesser carbon monoxide, sulfur dioxide, and unburned hydrocarbons than petroleum-based fuel. The purpose of the present work is to present an efficient process using reactive distillation columns applied to biodiesel production. Reactive distillation is the simultaneous implementation of reaction and separation within a single unit of column. Nowadays, it is appropriately called "Intensified Process". This combined operation is especially suited for the chemical reaction limited by equilibrium constraints, since one or more of the products of the reaction are continuously separated from the reactants. This work presents the biodiesel production from soybean oil and bioethanol by reactive distillation. Different variables affect the conventional biodiesel production process such as: catalyst concentration, reaction temperature, level of agitation, ethanol/soybean oil molar ratio, reaction time, and raw material type. In this study, the experimental design was used to optimize the following process variables: the catalyst concentration (from 0.5 wt.% to 1.5 wt.%), the ethanol/soybean oil molar ratio (from 3:1 to 9:1). The reactive column reflux rate was 83 ml/min, and the reaction time was 6 min. PMID:20221864

  9. Systematic Study of Technetium Production by Proton-Induced Reactions on Molybdenum

    NASA Astrophysics Data System (ADS)

    Lamere, Edward; Gilardy, Gwenaelle; Meisel, Zach; Moran, Michael; Skulski, Michael; Couder, Manoel

    2015-10-01

    Recent shortages in the world-wide supply of 99mTc have sparked interest in developing alternative production methods which do not rely on fission based 99Mo. The direct production of 99mTc from proton induced reactions on enriched 100Mo targets is one such approach. With this approach, 99mTc must be chemically extracted from the irradiated target and therefore radiopharmaceuticals will contain a mixture of all Tc-species produced from the proton bombardment. Commercial viability of cyclotron-produced 99mTc will depend on a number of factors including, production yield, radiochemical purity, and specific activity. Reactions on trace impurities in the targets has been shown to impact these factors dramatically. Precise cross-section measurements for not just the main reaction, 99mTc(p,2n), but for all Mo + p reactions that lead to Tc or Mo species are required for proper assessment of this 99mTc production technique. We will introduce a systematic study of proton-induced reactions on 92, 94-98, 100 Mo currently being performed at the University of Notre Dame. First results of 96Mo + p reactions will be presented. NRC-HQ-12-G-38-0073.

  10. Quantum Chemical Study of the Reaction of C+ with Interstellar Ice: Predictions of Vibrational and Electronic Spectra of Reaction Products

    NASA Astrophysics Data System (ADS)

    Woon, David E.

    2015-06-01

    The C+ cation (CII) is the dominant form of carbon in diffuse clouds and an important tracer for star formation in molecular clouds. We studied the low energy deposition of C+ on ice using density functional theory calculations on water clusters as large as 18 H2O. Barrierless reactions occur with water to form two dominant sets of products: HOC + H3O+ and CO- + 2H3O+. In order to provide testable predictions, we have computed both vibrational and electronic spectra for pure ice and processed ice clusters. While vibrational spectroscopy is expected to be able to discern that C+ has reacted with ice by the addition of H3O+ features not present in pure ice, it does not provided characteristic bands that would discern between HOC and CO-. On the other hand, predictions of electronic spectra suggest that low energy absorptions may occur for CO- and not HOC, making it possible to distinguish one product from the other.

  11. Investigation of terpinolene + ozone or terpinolene + nitrate radical reaction products using denuder/filter apparatus

    NASA Astrophysics Data System (ADS)

    Harrison, Joel C.; Wells, J. R.

    2013-12-01

    Terpinolene's (1-methyl-4-(propan-2-ylidene)cyclohexene) reaction with ozone or the nitrate radical was investigated using a denuder/filter apparatus in order to characterize gas-phase and particulate reaction products. Identification of the reaction products (i.e., aldehydes, ketones, dicarbonyls and carboxylic acids) was made using two derivatization methods; O-(2,3,4,5,6-pentafluorobenzyl)hydroxylamine (PFBHA) to derivatize the carbonyl products or 3-Ethyl-1-[3-(dimethylamino)propyl]carbodiimide hydrochloride (EDC) and 2,2,2-trifluoroethylamine hydrochloride (TFEA) to derivatize the carboxylic acid products. Proposed carbonyl products for ozonolysis of terpinolene are: 4-methylcyclohex-3-en-1-one, 2-hydroxy-4-methylcyclohex-3-en-1-one, glyoxal, methyl glyoxal, 3-oxobutanal, and 6-oxo-3-(propan-2-ylidene)heptanal. Proposed carbonyl products for nitrate radical reaction of terpinolene are: 2-hydroxy-4-methylcyclohex-3-en-1-one, glyoxal, methyl glyoxal, and 4-oxopentanal. No carboxylic acid products were detected with either oxidizing reactant.

  12. Investigation of terpinolene + ozone or terpinolene + nitrate radical reaction products using denuder/filter apparatus

    PubMed Central

    Harrison, Joel C.; Wells, J.R.

    2015-01-01

    Terpinolene’s (1-methyl-4-(propan-2-ylidene)cyclohexene) reaction with ozone or the nitrate radical was investigated using a denuder/filter apparatus in order to characterize gas-phase and particulate reaction products. Identification of the reaction products (i.e., aldehydes, ketones, dicarbonyls and carboxylic acids) was made using two derivatization methods; O-(2,3,4,5,6-pentafluorobenzyl)hydroxylamine (PFBHA) to derivatize the carbonyl products or 3-Ethyl-1-[3-(dimethylamino)propyl]carbodiimide hydrochloride (EDC) and 2,2,2-trifluoroethylamine hydrochloride (TFEA) to derivatize the carboxylic acid products. Proposed carbonyl products for ozonolysis of terpinolene are: 4-methylcyclohex-3-en-1-one, 2-hydroxy-4-methylcyclohex-3-en-1-one, glyoxal, methyl glyoxal, 3-oxobutanal, and 6-oxo-3-(propan-2-ylidene)heptanal. Proposed carbonyl products for nitrate radical reaction of terpinolene are: 2-hydroxy-4-methylcyclohex-3-en-1-one, glyoxal, methyl glyoxal, and 4-oxopentanal. No carboxylic acid products were detected with either oxidizing reactant. PMID:26527171

  13. Degradation of (14)C-labeled few layer graphene via Fenton reaction: Reaction rates, characterization of reaction products, and potential ecological effects.

    PubMed

    Feng, Yiping; Lu, Kun; Mao, Liang; Guo, Xiangke; Gao, Shixiang; Petersen, Elijah J

    2015-11-01

    Graphene has attracted considerable commercial interest due to its numerous potential applications. It is inevitable that graphene will be released into the environment during the production and usage of graphene-enabled consumer products, but the potential transformations of graphene in the environment are not well understood. In this study, (14)C-labeled few layer graphene (FLG) enabled quantitative measurements of FLG degradation rates induced by the iron/hydrogen peroxide induced Fenton reaction. Quantification of (14)CO2 production from (14)C-labeled FLG revealed significant degradation of FLG after 3 days with high H2O2 (200 mmol L(-1)) and iron (100 μmol L(-1)) concentrations but substantially lower rates under environmentally relevant conditions (0.2-20 mmol L(-1) H2O2 and 4 μmol L(-1) Fe(3+)). Importantly, the carbon-14 labeling technique allowed for quantification of the FLG degradation rate at concentrations nearly four orders of magnitude lower than those typically used in other studies. These measurements revealed substantially faster degradation rates at lower FLG concentrations and thus studies with higher FLG concentrations may underestimate the degradation rates. Analysis of structural changes to FLG using multiple orthogonal methods revealed significant FLG oxidation and multiple reaction byproducts. Lastly, assessment of accumulation of the degraded FLG and intermediates using aquatic organism Daphnia magna revealed substantially decreased body burdens, which implied that the changes to FLG caused by the Fenton reaction may dramatically impact its potential ecological effects. PMID:26210029

  14. O/S-1/ interactions - The product channels. [collisional electron quenching and chemical reaction pathway frequencies

    NASA Technical Reports Server (NTRS)

    Slanger, T. G.; Black, G.

    1978-01-01

    The first measurements are reported of the reaction pathways for the interaction between oxygen atoms in the 4.19 eV S-1 state, and four molecules, N2O, CO2, H2O, and NO. Distinction is made between three possible paths - quenching to O(D-1), quenching to O(P-3), and chemical reaction. With N2O, the most reasonable interpretation of the data indicates that there no reaction, in sharp contrast with the interaction between O(D-1) and N2O, which proceeds entirely by reaction. Similarly, there is no reaction with CO2. With H2O, the reactive pathway is the dominant one, although electronic quenching is not negligible. With NO, O(D-1) is the preferred product.

  15. Reactions of the CN Radical with Benzene and Toluene: Product Detection and Low-Temperature Kinetics

    SciTech Connect

    Trevitt, Adam J.; Goulay, Fabien; Taatjes, Craig A.; Osborn, David L.; Leone, Stephen R.

    2009-12-23

    Low temperature rate coefficients are measured for the CN + benzene and CN + toluene reactions using the pulsed Laval nozzle expansion technique coupled with laser-induced fluorescence detection. The CN + benzene reaction rate coefficient at 105, 165 and 295 K is found to be relatively constant over this temperature range, 3.9 - 4.9 x 10-10 cm3 molecule-1 s-1. These rapid kinetics, along with the observed negligible temperature dependence, are consistent with a barrierless reaction entrance channel and reaction efficiencies approaching unity. The CN + toluene reaction is measured to have a slower rate coefficient of 1.3 x 10-10 cm3 molecule-1 s-1 at 105 K. At room temperature, non-exponential decay profiles are observed for this reaction that may suggest significant back-dissociation of intermediate complexes. In separate experiments, the products of these reactions are probed at room temperature using synchrotron VUV photoionization mass spectrometry. For CN + benzene, cyanobenzene (C6H5CN) is the only product recorded with no detectable evidence for a C6H5 + HCN product channel. In the case of CN + toluene, cyanotoluene (NCC6H4CH3) constitutes the only detected product. It is not possible to differentiate among the ortho, meta and para isomers of cyanotoluene because of their similar ionization energies and the ~;; 40 meV photon energy resolution of the experiment. There is no significant detection of benzyl radicals (C6H5CH2) that would suggest a H-abstraction or a HCN elimination channel is prominent at these conditions. As both reactions are measured to be rapid at 105 K, appearing to have barrierless entrance channels, it follows that they will proceed efficiently at the temperatures of Saturn?s moon Titan (~;;100 K) and are also likely to proceed at the temperature of interstellar clouds (10-20 K).

  16. Attempt to confirm superheavy element production in the 48Ca +238U reaction

    SciTech Connect

    Gregorich, K.E.; Loveland, W.; Peterson, D.; Zielinski, P.M.; Nelson, S.L.; Chung, Y.H.; Dullmann, Ch.E.; Folden III, C.M.; Aleklett,K.; Eichler, R.; Hoffman D.C.; Omtvedt, J.P.; Pang, G.K.; Schwantes,J.M.; Soverna, S.; Sprunger, P.; Sudowe, R.; Wilson, R.E.; Nitsche, H.

    2005-03-24

    An attempt to confirm production of superheavy elements in the reaction of 48Ca beams with actinide targets has been performed using the 238U(48Ca,3n)283112 reaction. Two 48Ca projectile energies were used, that spanned the energy range where the largest cross sections have been reported for this reaction. No spontaneous fission events were observed. No alpha decay chains consistent with either reported or theoretically predicted element 112 decay properties were observed. The cross section limits reached are significantly smaller than the recently reported cross sections.

  17. Production of exotic isotopes in complete fusion reactions with radioactive beams

    NASA Astrophysics Data System (ADS)

    Sargsyan, V. V.; Zubov, A. S.; Adamian, G. G.; Antonenko, N. V.; Heinz, S.

    2013-11-01

    The isotopic dependence of the complete fusion (capture) cross section is analyzed in the reactions 130,132,134,136,138,140,142,144,146,148,150Xe+48Ca with stable and radioactive beams. It is shown for the first time that the very neutron-rich nuclei 186-191W can be reached with relatively large cross sections by complete fusion reactions with radioactive ion beams at incident energies near the Coulomb barrier. A comparison between the complete fusion and fragmentation reactions for the production of neutron-rich W and neutron-deficient Rn isotopes is performed.

  18. Separation of Dimethyl Ether from Syn-Gas Components by Poly(dimethylsiloxane) and Poly(4-methyl-1-pentene) Membranes

    SciTech Connect

    Christopher J. Orme; Frederick F. Stewart

    2011-05-01

    Permeability and selectivity in gas transport through poly(4-methyl-1-pentene) (TPX) and poly(dimethylsiloxane) (PDMS) using variable temperature mixed gas experiments is reported. Selected gases include H2, CO, CH4, CO2, and dimethyl ether (DME). The DME data is the first to be reported through these membranes. In this paper, the chosen polymers reflect both rubbery and crystalline materials. Rubbery polymers tend to be weakly size sieving, which, in this work, has resulted in larger permeabilities, lower separation factors, and lower activation energies of permeation (Ep). Conversely, the crystalline TPX membranes showed much greater sensitivity to penetrant size; although the gas condensability also played a role in transport.

  19. Mutagenicity screening of reaction products from the enzyme-catalyzed oxidation of phenolic pollutants

    SciTech Connect

    Massey, I.J.; Aitken, M.D.; Ball, L.M.; Heck, P.E. . Dept. of Environmental Sciences and Engineering)

    1994-11-01

    Phenol-oxidizing enzymes such as peroxidases, laccases, and mushroom polyphenol oxidase are capable of catalyzing the oxidation of a wide range of phenolic pollutants. Although the use of these enzymes in waste-treatment applications has been proposed by a number of investigators, little information exists on the toxicological characteristics of the oxidation products. The enzymes chloroperoxidase, horseradish peroxidase, lignin peroxidase, and mushroom polyphenol oxidase were used in this study to catalyze the oxidation of phenol, several mono-substituted phenols, and pentachlorophenol. Seventeen reaction mixtures representing selected combinations of enzyme and parent phenol were subjected to mutagenicity screening using the Ames Salmonella typhimurium plate incorporation assay; five selected mixtures were also incubated with the S9 microsomal preparation to detect the possible presence of promutagens. The majority of reaction mixtures tested were not directly mutagenic, and none of those tested with S9 gave a positive response. Such lack of mutagenicity of enzymatic oxidation products provides encouragement for establishing the feasibility of enzyme-catalyzed oxidation as a waste-treatment process. The only positive responses were obtained with reaction products from the lignin peroxidase-catalyzed oxidation of 2-nitrophenol and 4-nitrophenol. Clear positive responses were observed when strain TA100 was incubated with 2-nitrophenol reaction-product mixtures, and when strain TA98 was incubated with the 4-nitrophenol reaction mixture. Additionally, 2,4-dinitrophenol was identified as a reaction product from 4-nitrophenol, and preliminary evidence indicates that both 2,4- and 2,6-dinitrophenol are produced from the oxidation of 2-nitrophenol. Possible mechanism by which these nitration reactions occur are discussed.

  20. Production of heavy neutron-rich nuclei in transfer reactions within the dinuclear system model

    NASA Astrophysics Data System (ADS)

    Zhu, Long; Feng, Zhao-Qing; Zhang, Feng-Shou

    2015-08-01

    The dynamics of nucleon transfer processes in heavy-ion collisions is investigated within the dinuclear system model. The production cross sections of nuclei in the reactions 136Xe+208Pb and 238U+248Cm are calculated, and the calculations are in good agreement with the experimental data. The transfer cross sections for the 58Ni+208Pb reaction are calculated and compared with the experimental data. We predict the production cross sections of neutron-rich nuclei 165-168 Eu, 169-173 Tb, 173-178 Ho, and 181-185Yb based on the reaction 176Yb+238U. It can be seen that the production cross sections of the neutron-rich nuclei 165Eu, 169Tb, 173Ho, and 181Yb are 2.84 μb, 6.90 μb, 46.24 μb, and 53.61 μb, respectively, which could be synthesized in experiment.

  1. 40 CFR 721.10485 - Reaction products of alcohols, alkyl alcohols, amino alcohols and methanol sodium salts (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10485 Reaction products of... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction products of alcohols,...

  2. 40 CFR 721.3830 - Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3830 Formaldehyde, reaction... chemical substance identified generically as Formaldehyde, reaction products with an alkylated phenol and... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Formaldehyde, reaction products...

  3. 40 CFR 721.10485 - Reaction products of alcohols, alkyl alcohols, amino alcohols and methanol sodium salts (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10485 Reaction products of... significant new uses subject to reporting. (1) The chemical substance identified generically as reaction... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction products of alcohols,...

  4. N4-methylation changes the conformation of (3S,6S)-3-alkyl-6-benzylpiperazine-2,5-diones from folded to extended

    NASA Astrophysics Data System (ADS)

    Nakao, Michiyasu; Hiroyama, Yuta; Fukayama, Shintaro; Sano, Shigeki

    2016-07-01

    N4-methylation of (3S,6S)-3-alkyl-6-benzylpiperazine-2,5-diones (S,S)-1a-c was found to change their folded conformation to an extended conformation. Conformational aspects of N1- and/or N4-methylated (S,S)-1a-c were revealed by single crystal X-ray crystallography and 1H NMR spectroscopy.

  5. Product energy distributions and energy partitioning in O atom reactions on surfaces

    NASA Technical Reports Server (NTRS)

    Halpern, Bret; Kori, Moris

    1987-01-01

    Surface reactions involving O atoms are likely to be highly exoergic, with different consequences if energy is channeled mostly to product molecules or surface modes. Thus the surface may become a source of excited species which can react elsewhere, or a sink for localized heat deposition which may disrupt the surface. The vibrational energy distribution of the product molecule contains strong clues about the flow of released energy. Two instructive examples of energy partitioning at surfaces are the Pt catalyzed oxidations: (1) C(ads) + O(ads) yields CO* (T is greater than 1000 K); and (2) CO(ads) + O(gas) yields CO2* (T is approx. 300 K). The infrared emission spectra of the excited product molecules were recorded and the vibrational population distributions were determined. In reaction 1, energy appeared to be statistically partitioned between the product CO and several Pt atoms. In reaction 2, partitioning was non-statistical; the CO2 asymmetric stretch distribution was inverted. In gas reactions these results would indicate a long lived and short lived activated complex. The requirement that Pt be heated in O atoms to promote reaction of atomic O and CO at room temperature is specifically addressed. Finally, the fraction of released energy that is deposited in the catalyst is estimated.

  6. The vinyl + NO reaction : determining the products with time-resolved Fourier transform spectroscopy.

    SciTech Connect

    Osborn, David L; Zou, Peng; Klippenstein, Stephen J.

    2005-01-01

    We have studied the vinyl + NO reaction using time-resolved Fourier transform emission spectroscopy, complemented by electronic structure and microcanonical RRKM rate coefficient calculations. To unambiguously determine the reaction products, three precursors are used to produce the vinyl radical by laser photolysis: vinyl bromide, methyl vinyl ketone, and vinyl iodide. The emission spectra and theoretical calculations indicate that HCN + CH{sub 2}O is the only significant product channel for the C{sub 2}H{sub 3} + NO reaction near room temperature, in contradiction to several reports in the literature. Although CO emission is observed when vinyl bromide is used as the precursor, it arises from the reaction of NO with photofragments other than vinyl. This conclusion is supported by the absence of CO emission when vinyl iodide or methyl vinyl ketone is used. Prompt emission from vibrationally excited NO is evidence of the competition between back dissociation and isomerization of the initially formed nitrosoethylene adduct, consistent with previous work on the pressure dependence of this reaction. Our calculations indicate that production of products is dominated by the low energy portion of the energy distribution. The calculation also predicts an upper bound of 0.19% for the branching ratio of the H{sub 2}CNH + CO channel, which is consistent with our experimental results.

  7. Antioxidant effect of non-enzymatic browning reaction products on linoleic acid

    SciTech Connect

    Kim, N.S.K.

    1987-01-01

    In aqueous lysine-sucrose model systems, the effects of reaction time, pH and molar ratio were studied on the formation of non-enzymatic browning reaction (NBR) products. The extent of sucrose hydrolysis was measured and the antioxidant effect of NBR products on linoleic acid emulsions was examined. Nuclear magnetic resonance (NMR) spectra were obtained at various stages of browning. Sucrose produced NMR produces with lysine in an aqueous system at 100/sup 0/C. The C-13 NMR spectra indicated that the NBR started when sucrose and lysine were dissolved in water. The C-13 NMR spectra also showed that heating did not have an effect on the gross composition of polymeric species. The absorbance at 480 nm of 0.75 M lysine-sucrose solution heated up to 6 hours increased with reaction times. The pH values of heated lysine-sucrose solution gradually decreased with reaction time. When 0.75 M sucrose or lysine solution was heated separately up to 6 hours, there were no changes in absorbance in pH. In the pH range of 3.52-6.35, higher absorbance was obtained from heated lysine-sucrose solution at acidic pH levels than at neutral pH levels. As the concentration of lysine and sucrose solution was increased, the absorbance increased. At longer reaction times or acidic pH levels, enhanced hydrolysis of sucrose to reducing sugars resulted in more NBR products. NBR products obtained at a longer reaction time, an acidic pH, and higher concentration of reactants showed a darker brown color and were effective in preventing the formation of peroxides. The oxygen uptake of linoleic acid emulsion having NBR products was smaller than that of linoleic acid emulsion without NBR products. Based on these results, it was concluded that sucrose may act as an antioxidant in processed foods containing both amino acids and lipids.

  8. Dietary Maillard reaction products and their fermented products reduce cardiovascular risk in an animal model.

    PubMed

    Oh, N S; Park, M R; Lee, K W; Kim, S H; Kim, Y

    2015-08-01

    This study examined the effects of Maillard reaction products (MRP) and MRP fermented by lactic acid bacteria on antioxidants and their enhancement of cardiovascular health in ICR mouse and rat models. In previous in vitro studies, the selected lactic acid bacteria were shown to significantly affect the activity of MRP. The expression of genes (e.g., superoxide dismutase, catalase, and glutathione peroxidase) related to antioxidant activity was upregulated by Maillard-reacted sodium caseinate (cMRP), and cMRP fermented by Lactobacillus fermentum H9 (F-cMRP) synergistically increased the expression of catalase and superoxide dismutase when compared with the high-cholesterol-diet group. Bleeding time, the assay for determination of antithrombotic activity, was significantly prolonged by Maillard-reacted whey protein concentration (wMRP) and wMRP fermented by Lactobacillus gasseri H10 (F-wMRP), similar to the bleeding time of the aspirin group (positive control). In addition, the acute pulmonary thromboembolism-induced mice overcame severe body paralysis or death in both the wMRP and the F-wMRP groups. In the serum-level experiment, cMRP and F-cMRP significantly reduced the serum total and low-density lipoprotein cholesterol levels and triglycerides but had only a slight effect on high-density lipoprotein cholesterol. The levels of aspartate transaminase and alanine transaminase also declined in the cMRP and F-cMRP intake groups compared with the high-cholesterol-diet group. In particular, F-cMRP showed the highest reducing effects on triglycerides, aspartate transaminase, and alanine transaminase. Moreover, the expression of cholesterol-related genes in the F-cMRP group demonstrated greater effects than for the cMRP group in the level of cholesterol 7 α-hydroxylase (CYP7A1), 3-hydroxy-3-methylglutaryl-CoA reductase (HMGR), and low-density lipoprotein receptors compared with the high-cholesterol-diet group. The protective role of cMRP and F-cMRP in the high

  9. Possibility of production of neutron-rich isotopes in transfer-type reactions at intermediate energies

    SciTech Connect

    Adamian, G. G.; Antonenko, N. V.; Lukyanov, S. M.; Penionzhkevich, Yu. E.

    2008-08-15

    The production cross sections of neutron-rich isotopes of Mg, Al, Si, P, S, Cl, Ar, K, Ca, Sc, and Ti in the multinucleon transfer reactions {sup 48}Ca(64 MeV/nucleon, 140 MeV/nucleon) + {sup 181}Ta and {sup 48}Ca(142 MeV/nucleon) + {sup nat}W are estimated. A good agreement of the calculated results with the available experimental data confirms the mechanism of multinucleon transfer at almost peripheral collisions at intermediate energies. The global trend of production cross section with the charge (mass) number of target in reactions with {sup 48}Ca beam is discussed for the future experiments.

  10. A Quantum State-Resolved Insertion Reaction: O((1)D) + H(2)(J = 0) --> OH((2) product operator product operator product operator, v, N) + H((2)S).

    PubMed

    Liu; Lin; Harich; Schatz; Yang

    2000-09-01

    The O((1)D) + H(2) --> OH + H reaction, which proceeds mainly as an insertion reaction at a collisional energy of 1.3 kilocalories per mole, has been investigated with the high-resolution H atom Rydberg "tagging" time-of-flight technique and the quasiclassical trajectory (QCT) method. Quantum state-resolved differential cross sections were measured for this prototype reaction. Different rotationally-vibrationally excited OH products have markedly different angular distributions, whereas the total reaction products are roughly forward and backward symmetric. Theoretical results obtained from QCT calculations indicate that this reaction is dominated by the insertion mechanism, with a small contribution from the collinear abstraction mechanism through quantum tunneling. PMID:10968786

  11. Synthesis and bioevaluation of 2-phenyl-4-methyl-1,3-selenazole-5-carboxylic acids as potent xanthine oxidase inhibitors.

    PubMed

    Guan, Qi; Cheng, Zengjin; Ma, Xiaoxue; Wang, Lijie; Feng, Dongjie; Cui, Yuanhang; Bao, Kai; Wu, Lan; Zhang, Weige

    2014-10-01

    A series of 2-phenyl-4-methyl-1,3-selenazole-5-carboxylic acid derivatives (8a-f, 9a-m) were synthesized and evaluated for inhibitory activity against xanthine oxidase in vitro. Structure-activity relationship analyses have also been presented. Most of the target compounds exhibited potency levels in the nanomolar range. Compound 9e emerged as the most potent xanthine oxidase inhibitor (IC50 = 5.5 nM) in comparison to febuxostat (IC50 = 18.6 nM). Steady-state kinetics measurements with the bovine milk enzyme indicated a mixed type inhibition with Ki and Ki' values of 0.9 and 2.3 nM, respectively. A molecular modeling study on compounds 9e was performed to gain an insight into its binding mode with xanthine oxidase, and to provide the basis for further structure-guided design of new non-purine xanthine oxidase inhibitors related with 2-phenyl-4-methyl-1,3-selenazole-5-carboxylic acid scaffold. PMID:25113879

  12. Counteracting H3K4 methylation modulators Set1 and Jhd2 co-regulate chromatin dynamics and gene transcription

    PubMed Central

    Ramakrishnan, Saravanan; Pokhrel, Srijana; Palani, Sowmiya; Pflueger, Christian; Parnell, Timothy J.; Cairns, Bradley R.; Bhaskara, Srividya; Chandrasekharan, Mahesh B.

    2016-01-01

    Histone H3K4 methylation is connected to gene transcription from yeast to humans, but its mechanistic roles in transcription and chromatin dynamics remain poorly understood. We investigated the functions for Set1 and Jhd2, the sole H3K4 methyltransferase and H3K4 demethylase, respectively, in S. cerevisiae. Here, we show that Set1 and Jhd2 predominantly co-regulate genome-wide transcription. We find combined activities of Set1 and Jhd2 via H3K4 methylation contribute to positive or negative transcriptional regulation. Providing mechanistic insights, our data reveal that Set1 and Jhd2 together control nucleosomal turnover and occupancy during transcriptional co-regulation. Moreover, we find a genome-wide co-regulation of chromatin structure by Set1 and Jhd2 at different groups of transcriptionally active or inactive genes and at different regions within yeast genes. Overall, our study puts forth a model wherein combined actions of Set1 and Jhd2 via modulating H3K4 methylation−demethylation together control chromatin dynamics during various facets of transcriptional regulation. PMID:27325136

  13. Isotope effects on the metabolism and pulmonary toxicity of butylated hydroxytoluene in mice by deuteration of the 4-methyl group

    SciTech Connect

    Mizutani, T.; Yamamoto, K.; Tajima, K.

    1983-06-30

    A comparative test in mice for pulmonary toxicity between butylated hydroxytoluene (2,6-di-tert.-butyl-4-methylphenol, BHT) and 2,6-di-tert.-butyl-4-(alpha, alpha, alpha-2H3)methylphenol (BHT-d3) showed a significantly lower toxic potency of the latter. The rate of in vitro BHT metabolism to 2,6-di-tert.-butyl-4-methylene-2,5-cyclohexadienone (BHT-QM) was slowed by deuterating BHT in the 4-methyl group. On the other hand, the rate of in vitro metabolism to 2,6-di-tert.-butyl-4-hydroxy-4-methyl-2,5-cyclohexadienone (BHT-OH) was increased with the deuteration. A similar isotope effect of the deuterium substitution on the in vivo metabolic rates of BHT was observed. These observations support the concept that the lung damage caused by BHT is mediated by BHT-QM. The pulmonary toxicity of 2-tert.-butyl-4-ethylphenol (4-EP) and their deuterated analogs was also compared. 2-tert.-Butyl-4-(1,1-2H2)ethylphenol (4-EP-d2) showed a significantly lower toxic potency than 4-EP, whereas 2-tert.-butyl-4-(2,2,2-2H3)ethylphenol (4-EP-d3) showed a toxic potency comparable to that of 4-EP. This result is consistent with the hypothesis that a quinone methide metabolite is responsible for the onset of lung damage produced by 4-EP as well as BHT.

  14. Paternal H3K4 methylation is required for minor zygotic gene activation and early mouse embryonic development

    PubMed Central

    Aoshima, Keisuke; Inoue, Erina; Sawa, Hirofumi; Okada, Yuki

    2015-01-01

    Epigenetic modifications, such as DNA methylation and histone modifications, are dynamically altered predominantly in paternal pronuclei soon after fertilization. To identify which histone modifications are required for early embryonic development, we utilized histone K-M mutants, which prevent endogenous histone methylation at the mutated site. We prepared four single K-M mutants for histone H3.3, K4M, K9M, K27M, and K36M, and demonstrate that overexpression of H3.3 K4M in embryos before fertilization results in developmental arrest, whereas overexpression after fertilization does not affect the development. Furthermore, loss of H3K4 methylation decreases the level of minor zygotic gene activation (ZGA) predominantly in the paternal pronucleus, and we obtained similar results from knockdown of the H3K4 methyltransferase Mll3/4. We therefore conclude that H3K4 methylation, likely established by Mll3/4 at the early pronuclear stage, is essential for the onset of minor ZGA in the paternal pronucleus, which is necessary for subsequent preimplantation development in mice. PMID:25925669

  15. Paternal H3K4 methylation is required for minor zygotic gene activation and early mouse embryonic development.

    PubMed

    Aoshima, Keisuke; Inoue, Erina; Sawa, Hirofumi; Okada, Yuki

    2015-07-01

    Epigenetic modifications, such as DNA methylation and histone modifications, are dynamically altered predominantly in paternal pronuclei soon after fertilization. To identify which histone modifications are required for early embryonic development, we utilized histone K-M mutants, which prevent endogenous histone methylation at the mutated site. We prepared four single K-M mutants for histone H3.3, K4M, K9M, K27M, and K36M, and demonstrate that overexpression of H3.3 K4M in embryos before fertilization results in developmental arrest, whereas overexpression after fertilization does not affect the development. Furthermore, loss of H3K4 methylation decreases the level of minor zygotic gene activation (ZGA) predominantly in the paternal pronucleus, and we obtained similar results from knockdown of the H3K4 methyltransferase Mll3/4. We therefore conclude that H3K4 methylation, likely established by Mll3/4 at the early pronuclear stage, is essential for the onset of minor ZGA in the paternal pronucleus, which is necessary for subsequent preimplantation development in mice. PMID:25925669

  16. Computational Raman spectroscopy of organometallic reaction products in lithium and sodium-based battery systems.

    PubMed

    Sánchez-Carrera, Roel S; Kozinsky, Boris

    2014-11-28

    A common approach to understanding surface reaction mechanisms in rechargeable lithium-based battery systems involves spectroscopic characterization of the product mixtures and matching of spectroscopic features to spectra of pure candidate reference compounds. This strategy, however, requires separate chemical synthesis and accurate characterization of potential reference compounds. It also assumes that atomic structures are the same in the actual product mixture as in the reference samples. We propose an alternative approach that uses first-principles computations of spectra of the possible reaction products and by-products present in advanced battery systems. We construct a library of computed Raman spectra for possible products, achieving excellent agreement with reference experimental data, targeting solid-electrolyte interphase in Li-ion cells and discharge products of Li-air cells. However, the solid-state crystalline structure of Li(Na) metal-organic compounds is often not known, making the spectra computations difficult. We develop and apply a novel technique of simplifying spectra calculations by using dimer-like representations of the solid state structures. On the basis of a systematic investigation, we demonstrate that molecular dimers of Li(Na)-based organometallic material provide relevant information about the vibrational properties of many possible solid reaction products. Such an approach should serve as a basis to extend existing spectral libraries of molecular structures relevant for understanding the link between atomic structures and measured spectroscopic data of materials in novel battery systems. PMID:25310385

  17. Worldwide withdrawal of medicinal products because of adverse drug reactions: a systematic review and analysis.

    PubMed

    Onakpoya, Igho J; Heneghan, Carl J; Aronson, Jeffrey K

    2016-07-01

    We have systematically identified medicinal products withdrawn worldwide because of adverse drug reactions, assessed the level of evidence used for making the withdrawal decisions, and explored the patterns of withdrawals over time. We searched PubMed, the WHO database of withdrawn products, and selected texts. We included products that were withdrawn after launch from 1950 onwards, excluding non-human and over-the-counter medicines. We assessed the levels of evidence on which withdrawals were based using the Oxford Center for Evidence Based Medicine Levels of Evidence. Of 353 medicinal products withdrawn from any country, only 40 were withdrawn worldwide. Anecdotal reports were cited as evidence for withdrawal in 30 (75%) and deaths occurred in 27 (68%). Hepatic, cardiac, and nervous system toxicity accounted for over 60% of withdrawals. In 28 cases, the first withdrawal was initiated by the manufacturer. The median interval between the first report of an adverse drug reaction that led to withdrawal and the first withdrawal was 1 year (range 0-43 years). Worldwide withdrawals occurred within 1 year after the first withdrawal in any country. In conclusion, the time it takes for drugs to be withdrawn worldwide after reports of adverse drug reactions has shortened over time. However, there are inconsistencies in current withdrawal procedures when adverse drug reactions are suspected. A uniform method for establishing worldwide withdrawal of approved medicinal products when adverse drug reactions are suspected should be developed, to facilitate global withdrawals. Rapid synthesis of the evidence on harms should be a priority when serious adverse reactions are suspected. PMID:26941185

  18. Kinetic and product distribution analysis of the reaction of atomic hydrogen with vinyl chloride

    SciTech Connect

    Barat, R.B.; Bozzelli, J.W.

    1992-03-19

    An elementary reaction mechanism has been developed to model the experimentally observed loss of vinyl chloride by reaction with atomic hydrogen, as well as the observed products. At the low-pressure, room temperature experimental conditions the consumption of C{sub 2}H{sub 3}Cl by reaction with H occurs primarily by nonipso attack by H on the =CH{sub 2} group to form (CH{sub 3}C{center_dot}HCl){sup {double_dagger}}. This energized complex then undergoes an H shift to form (C{center_dot}H{sub 2}CH{sub 2}Cl){sup {double_dagger}}, which decomposes to form Cl + CH{sub 2}=CH{sub 2}. Collisional stabilization of the original adduct is also important. Abstraction of Cl by H is negligible in these conditions. The authors` mechanism is based on quantum Rice-Ramsperger-Kassel (QRRK) analysis of the reactions of the energized adducts from the separately considered ipso and nonipso additions. The authors also utilized transition-state theory for the isomerization reaction, evaluated with literature rate constants and barriers. The authors extend the QRRK calculations to higher pressures and temperatures for use by the modeling community. A mechanistic pathway is presented to explain the formation of the various reaction products observed. 26 refs., 13 figs., 7 tabs.

  19. Kinetics and Product Yields of the Gas-Phase Reactions of Isoprene Hydroxynitrates and Isoprene Carbonynitrates

    NASA Astrophysics Data System (ADS)

    Abdelhamid, A.; Addala, R.; Vizenor, N.; Scruggs, A.; Tyndall, G. S.; Orlando, J. J.; Le, T.; Cardenas, E.; Maitra, S.; Hasson, A. S.

    2013-12-01

    Isoprene nitrates are formed in the troposphere from the reactions of isoprene with OH in the presence of NOx during the day and with NO3 during the night. Depending on their subsequent reactions, these compounds may be reservoirs or sinks for NOx, and may contribute to secondary organic aerosol formation. In this work, two isoprene hydroxynitrates (CH2=CHC(ONO2)(CH3)CH2OH, 1,2-IHN and CH2OHCH(ONO2)C(CH3)=CH2, 4,3-IHN ) and one isoprene carbonyl nitrate (CH2=CHC(ONO2)(CH3)CHO, ICN)) were synthesized. The kinetics and product yields from their reaction with O3, OH, NO3 and Cl were then investigated in a photochemical reactor using a combination of long-path Fourier transform infra-red spectroscopy, proton transfer reaction mass spectrometry and gas chromatography with flame ionization detection. Measured rate coefficients are consistent with reaction with OH and NO3 as the major chemical sinks for these compounds. Measured product yields imply that NOx is not released from these compounds in their reactions with atmospheric oxidants.

  20. Rate and product measurements for the reactions of OH with I/sub 2/ and ICl at 298 K: separation of gas-phase and surface reaction components

    SciTech Connect

    Loewenstein, L.M.; Anderson, J.G.

    1985-12-05

    The kinetic behavior of OH with I/sub 2/ and ICl is reported within the context of a series of radical-halogen reactions to investigate the mechanism of such reactions through studies of reactivity trends. Atomic I and Cl products of the title reactions are measured by resolved resonance fluorescence vapor lamps. IO and ClO are detected by chemically converting them, using NO, to I and Cl, respectively. The rate constant of the reaction H + ICl has been measured at 298 K; its only product channel is I + HCl. Magnitudes of the rate constants of these OH reactions substantiate the reactivity trends in the OH-halogen system based on an electron-transfer mechanism from the highest occupied molecular orbital of the halogen to the lowest unoccupied orbital of the hydroxyl. The rapidity of the OH + I/sub 2/ reaction makes it a possible source of HOI for photochemical studies. 31 references, 11 figures, 2 tables.

  1. Vibrational Excitation of Both Products of the Reaction of CN Radicals with Acetone in Solution

    PubMed Central

    2015-01-01

    Transient electronic and vibrational absorption spectroscopy unravel the mechanisms and dynamics of bimolecular reactions of CN radicals with acetone in deuterated chloroform solutions. The CN radicals are produced by ultrafast ultraviolet photolysis of dissolved ICN. Two reactive forms of CN radicals are distinguished by their electronic absorption bands: “free” (uncomplexed) CN radicals, and “solvated” CN radicals that are complexed with solvent molecules. The lifetimes of the free CN radicals are limited to a few picoseconds following their photolytic production because of geminate recombination to ICN and INC, complexation with CDCl3 molecules, and reaction with acetone. The acetone reaction occurs with a rate coefficient of (8.0 ± 0.5) × 1010 M–1 s–1 and transient vibrational spectra in the C=N and C=O stretching regions reveal that both the nascent HCN and 2-oxopropyl (CH3C(O)CH2) radical products are vibrationally excited. The rate coefficient for the reaction of solvated CN with acetone is 40 times slower than for free CN, with a rate coefficient of (2.0 ± 0.9) × 109 M–1 s–1 obtained from the rise in the HCN product v1(C=N stretch) IR absorption band. Evidence is also presented for CN complexes with acetone that are more strongly bound than the CN–CDCl3 complexes because of CN interactions with the carbonyl group. The rates of reactions of these more strongly associated radicals are slower still. PMID:26192334

  2. Vibrational Excitation of Both Products of the Reaction of CN Radicals with Acetone in Solution.

    PubMed

    Dunning, Greg T; Preston, Thomas J; Greaves, Stuart J; Greetham, Gregory M; Clark, Ian P; Orr-Ewing, Andrew J

    2015-12-17

    Transient electronic and vibrational absorption spectroscopy unravel the mechanisms and dynamics of bimolecular reactions of CN radicals with acetone in deuterated chloroform solutions. The CN radicals are produced by ultrafast ultraviolet photolysis of dissolved ICN. Two reactive forms of CN radicals are distinguished by their electronic absorption bands: "free" (uncomplexed) CN radicals, and "solvated" CN radicals that are complexed with solvent molecules. The lifetimes of the free CN radicals are limited to a few picoseconds following their photolytic production because of geminate recombination to ICN and INC, complexation with CDCl3 molecules, and reaction with acetone. The acetone reaction occurs with a rate coefficient of (8.0 ± 0.5) × 10(10) M(-1) s(-1) and transient vibrational spectra in the C═N and C═O stretching regions reveal that both the nascent HCN and 2-oxopropyl (CH3C(O)CH2) radical products are vibrationally excited. The rate coefficient for the reaction of solvated CN with acetone is 40 times slower than for free CN, with a rate coefficient of (2.0 ± 0.9) × 10(9) M(-1) s(-1) obtained from the rise in the HCN product v1(C═N stretch) IR absorption band. Evidence is also presented for CN complexes with acetone that are more strongly bound than the CN-CDCl3 complexes because of CN interactions with the carbonyl group. The rates of reactions of these more strongly associated radicals are slower still. PMID:26192334

  3. Food Processing and Maillard Reaction Products: Effect on Human Health and Nutrition.

    PubMed

    Tamanna, Nahid; Mahmood, Niaz

    2015-01-01

    Maillard reaction produces flavour and aroma during cooking process; and it is used almost everywhere from the baking industry to our day to day life to make food tasty. It is often called nonenzymatic browning reaction since it takes place in the absence of enzyme. When foods are being processed or cooked at high temperature, chemical reaction between amino acids and reducing sugars leads to the formation of Maillard reaction products (MRPs). Depending on the way the food is being processed, both beneficial and toxic MRPs can be produced. Therefore, there is a need to understand the different types of MRPs and their positive or negative health effects. In this review we have summarized how food processing effects MRP formation in some of the very common foods. PMID:26904661

  4. Food Processing and Maillard Reaction Products: Effect on Human Health and Nutrition

    PubMed Central

    Tamanna, Nahid; Mahmood, Niaz

    2015-01-01

    Maillard reaction produces flavour and aroma during cooking process; and it is used almost everywhere from the baking industry to our day to day life to make food tasty. It is often called nonenzymatic browning reaction since it takes place in the absence of enzyme. When foods are being processed or cooked at high temperature, chemical reaction between amino acids and reducing sugars leads to the formation of Maillard reaction products (MRPs). Depending on the way the food is being processed, both beneficial and toxic MRPs can be produced. Therefore, there is a need to understand the different types of MRPs and their positive or negative health effects. In this review we have summarized how food processing effects MRP formation in some of the very common foods. PMID:26904661

  5. Characterization of the products formed by the reaction of trichlorocyanuric acid with 2-propanol.

    PubMed

    Sandercock, P Mark L; Barnett, Julie S

    2009-11-01

    We report a recent investigation into the death of a cat that was initially thought to involve intentionally burning the animal via the use of an ignitable liquid. The exposure of the animal to flame was ruled out. Instead, forensic investigation revealed the intentional mixing together of a common outdoor swimming pool chlorinator, trichlorocyanuric acid (TCCA), and 2-propanol (aka, isopropyl alcohol or rubbing alcohol). The reaction of these two chemicals resulted in the formation of cyanuric acid residue, hydrochloric acid, and the evolution of a significant volume of chlorine gas. Further alpha-chlorination side reactions also occurred between 2-propanol and TCCA to produce a variety of chlorinated 2-propanone species that were detected on the submitted evidence. The identification of the products of both the main reaction and the side reactions allowed the authors to determine what chemicals were originally mixed together by the culprit. PMID:19818110

  6. Expected production of new exotic α emitters 108Xe and 112Ba in complete fusion reactions

    NASA Astrophysics Data System (ADS)

    Kalandarov, Sh. A.; Adamian, G. G.; Antonenko, N. V.; Wieleczko, J. P.

    2016-05-01

    The production cross sections of neutron-deficient isotopes Xe-110108 and Ba-114112 in the complete fusion reactions Ni,5658+54Fe and Ni,5658+58Ni with stable and radioactive beams are studied with the dinuclear system model. The calculated results are compared with the available experimental data. The optimal beam energies and corresponding maximum production cross sections of new isotopes 108Xe and 112Ba are predicted.

  7. [Vigilance for veterinary medicinal products: reports of adverse reactions in the year 2012].

    PubMed

    Müntener, C R; Bruckner, L; Kupper, J; Althaus, F R; Schäublin, M

    2013-11-01

    197 adverse reactions of Swissmedic-authorized veterinary medicinal products were reported during the year 2012 (2011: 167). Species and drug classes remain unchanged over the years: most of the reports related to reactions following the use of antiparasitic products (37.6 %), antiinfectives (15.7 %) or non-steroidal antiinflammatory drugs (11.7 %) in companion animals (94 dogs and 53 cats) followed by cattle/calves (29). Additionally, 45 cases transmitted by the Swiss Toxicological Information Centre in Zürich were processed. We discuss a paradoxical reaction under the potential influence of acepromazine as well as a modified protocol for treating permethrin intoxication in cats. Finally, the vaccinovigilance program received 95 declarations following the application of various vaccines, mainly to dogs or cats. PMID:24168771

  8. Detection and analysis of polymerase chain reaction products by mass spectrometry

    SciTech Connect

    Hurst, G.B., Doktycz, M.J., Britt, P.F., Vass, A.A., Buchanan, M.V.

    1997-02-01

    This paper describes recent and ongoing efforts to overcome some of the obstacles to more routine and robust application of MALDI-TOF to analysis of polymerase chain reaction products and other information- bearing nucleic acid molecules. Methods for purifying nucleic acid samples are described, as is the application of delayed extraction TOF mass spectrometry to analysis of short oligonucleotides.

  9. THE OZONE REACTION WITH BUTADIENE: FORMATION OF TOXIC PRODUCTS. (R826236)

    EPA Science Inventory

    Abstract

    The formation yields of acrolein, 1,2-epoxy-3-butene and OH radicals have been measured from reaction of ozone with 1,3-butadiene at room temperature and atmosphere pressure. 1,3,5-Trimethyl benzene was added to scavenge OH radicals in measurements of product ...

  10. 40 CFR 721.9484 - Dimer acid/rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9484 Dimer acid/rosin amidoamine reaction product (generic). (a... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Dimer acid/rosin amidoamine...

  11. 40 CFR 721.9484 - Dimer acid/rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9484 Dimer acid/rosin amidoamine reaction product (generic). (a... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Dimer acid/rosin amidoamine...

  12. 40 CFR 721.9484 - Dimer acid/rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9484 Dimer acid/rosin amidoamine reaction product (generic). (a... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Dimer acid/rosin amidoamine...

  13. 40 CFR 721.9484 - Dimer acid/rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9484 Dimer acid/rosin amidoamine reaction product (generic). (a... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Dimer acid/rosin amidoamine...

  14. 40 CFR 721.9484 - Dimer acid/rosin amidoamine reaction product (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9484 Dimer acid/rosin amidoamine reaction product (generic). (a... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Dimer acid/rosin amidoamine...

  15. Production of hydrogen bromide by bromine-methane reactions at elevated temperature.

    SciTech Connect

    Bradshaw, Robert W.; Larson, Richard S.

    2003-05-01

    Hydrogen bromide is a potentially useful intermediate for hydrogen production by electrolysis because it has a low cell potential and is extremely soluble in water. Processes have been proposed to exploit these properties, but among the important issues to be resolved is the efficiency of HBr production from hydrocarbon precursors. This investigation evaluated a fundamental facet of such a technology by studying the reaction of methane and bromine at elevated temperature to determine the yield and kinetics of HBr formation. Laboratory experimentation and computational chemistry were combined to provide a description of this reaction for possible application to reactor design at a larger scale. Experimental studies with a tubular flow reactor were used to survey a range of reactant ratios and reactor residence times at temperatures between 500 C and 800 C. At temperatures near 800 C with excess methane, conversions of bromine to HBr exceeded 90% and reaction products included solid carbon (soot) in stoichiometric amounts. At lower temperatures, HBr conversion was significantly reduced, the products included much less soot, and the formation of bromocarbon compounds was indicated qualitatively. Calculations of chemical equilibrium behavior and reaction kinetics for the experimental conditions were performed using the Sandia CHEMKIN package. An elementary multistep mechanism for the gas-phase chemistry was used together with a surface mechanism that assumed facile deposition of radical species at the reactor walls. Simulations with the laminar-flow boundary-layer code of the CHEMKIN package gave reasonable agreement with experimental data.

  16. The reaction product of hydrogen and electro-refined plutonium observed by in situ electron microscopy

    NASA Astrophysics Data System (ADS)

    Brierley, M.; Knowles, J. P.; Preuss, M.

    2016-02-01

    Electro-refined plutonium was reacted with hydrogen within the preparation chamber of a Field Emission Gun Scanning Electron Microscope and in situ images were obtained. The plutonium hydride reaction product was observed to have precipitated at the oxide metal interface as angular particulates (ca 2 μm in length) and was also present within micro cracks intersecting the surface.

  17. Polyol-acid anhydride-n-alkyl-alkylene diamine reaction product and motor fuel composition containing same

    SciTech Connect

    Sung, R.L.; Jenkins, R.H. Jr.

    1987-02-17

    A fuel composition for an internal combustion engine comprising: (a) a major portion of a liquid hydrocarbon fuel and (b) a minor amount, as a deposit inhibitor additive, of a reaction product of a process comprising: (i) reacting a dibasic acid anhydride with a polyol, thereby forming an ester of maleic acid; (ii) reacting the ester of maleic acid with an N-alkyl-alkylene diamine, thereby forming the reaction product; and (iii) recovering the reaction product.

  18. Prodrug design, synthesis and pharmacokinetic evaluation of (3′ R, 4′ R)-3-hydroxymethyl-4-methyl-3′,4′-di-O-(S)-camphanoyl-(+)-cis-khellactone

    PubMed Central

    Guo, Huanfang; Zhuang, Xiaomei; Qian, Keduo; Sun, Lianqi; Wang, Xiaofeng; Li, Hua; Lee, Kuohsiung; Xie, Lan

    2013-01-01

    3-Hydroxymethyl-4-methyl-DCK (3, HMDCK) was discovered previously as a potent HIV non-nucleoside reverse transcriptase inhibitor (NNRTIs) (EC50: 0.004 μM, TI: 6225) with a novel mechanism of action. It exerts anti-HIV activity by inhibiting the production of HIV-1 double-stranded viral DNA from a single-stranded DNA intermediate, rather than blocking the generation of single-stranded DNA from a RNA template, which is the mechanism of action of current HIV-1 RT inhibitors. However, the insufficient metabolic stability of 3 limits its further clinical development. In the current study, a series of ester prodrugs of 3 was designed and synthesized to explore the new drug candidates as NNRTIs. The l-alanine ester prodrug 10 exhibited desirable pharmacokinetic properties in vitro and in vivo and showed improved oral bioavailability of 26% in rat, and would be a potential clinical candidate as a new anti-AIDS drug. PMID:23687633

  19. Creatine is a scavenger for methylglyoxal under physiological conditions via formation of N-(4-methyl-5-oxo-1-imidazolin-2-yl)sarcosine (MG-HCr).

    PubMed

    Löbner, Jürgen; Degen, Julia; Henle, Thomas

    2015-03-01

    Following incubation of methylglyoxal and creatine under physiological conditions, N-(4-methyl-5-oxo-1-imidazolin-2-yl)sarcosine (MG-HCr) was isolated and identified by NMR and mass spectrometry. Due to its rapid formation, MG-HCr represents a specific product following "scavenging" of methylglyoxal by creatine. Using hydrophilic interaction chromatography coupled to mass spectrometry, MG-HCr was analyzed in urine samples of healthy volunteers. Daily MG-HCr excretion of nonvegetarians ranged from 0.35 to 3.84 μmol/24 h urine (median: 0.90 μmol/24 h urine) and of vegetarians from 0.11 to 0.31 μmol/24 h urine (median: 0.19 μmol/24 h urine), indicating that formation of MG-HCr in vivo is influenced by the dietary intake of creatine. The trapping of methylglyoxal by creatine may delay the formation of advanced glycation compounds in vivo and, therefore, could be of special importance in situations in which the body has to deal with pathophysiologically increased amounts of dicarbonyl compounds ("carbonyl stress"), for instance in diabetic patients. PMID:25655840

  20. Products of the gas-phase reactions of O{sub 3} with alkenes

    SciTech Connect

    Atkinson, R.; Tuazon, E.C.; Aschmann, S.M.

    1995-12-01

    Selected products of the gas-phase reactions of a series of alkenes (1-pentene, 1-hexene, 1-heptene, 1-octene, 2,3-dimethyl-l-butene, cyclopentene and 1-methylcyclohexene) with O{sub 3} have been identified and quantified by gas chromatography and in situ Fourier transform infrared absorption spectroscopy. Because OH radicals are formed in these O{sub 3} reactions, experiments were carried out in the presence of sufficient cyclohexane or n-octane to scavenge > 90 % of the OH radicals formed. OH radical formation yields from the O{sub 3}-alkene reactions were derived from the amounts of cyclohexanone and cyclohexanol formed in O{sub 3}-alkene-cyclohexane-air mixtures. The molar yields of the carbonyls products R{sub 1}C(O)R{sub 2} plus HCHO from the O{sub 3} reactions with the five 1-alkenes (R{sub 1}R{sub 2}C=CH{sub 2}) studied were 1.1 {plus_minus} 0.1, as expected from the presently accepted reaction mechanism.

  1. Statistical product-state distributions for ultracold exoergic reactions in external fields

    NASA Astrophysics Data System (ADS)

    Gonzalez-Martinez, Maykel Leonardo; Bonnet, Laurent; Larregaray, Pascal

    2014-05-01

    The first ultracold chemistry experiments were recently performed at JILA, Colorado. Using an ultracold gas of KRb molecules, the group demonstrated strong effects on reaction rates due to quantum statistics, external electric fields, and reduced dimensionality/orientation. While Quéméner and Bohn provided the theoretical interpretation of the observed loss rates, Idziaszek and coworkers, and Gao have developed simple quantum models for reaction rates and identified different universality classes. The most important open question is that of product-state distributions. These are very sensitive to the details of the reaction dynamics and could lead to a deeper understanding of the underlying physics. A priori, a rigorous description of these reactions can be derived from the quantum-mechanical formalism of Tscherbul and Krems. Yet, as argued by Mayle et al., the huge number of rovibrational states involved makes such approach impractical for most cases of current experimental interest. I will discuss our efforts in deriving statistical product-state distributions for ultracold exoergic reactions in external fields. These can be used as benchmarks for the funding assumptions of the theory and provide tests for the statistical arguments of Mayle et al. MLGM acknowledges support from FP7/2007-2013, grant No. 330623.

  2. Induction of mitotic gene conversion by browning reaction products and its modulation by naturally occurring agents.

    PubMed

    Rosin, M P; Stich, H F; Powrie, W D; Wu, C H

    1982-05-01

    Mitotic gene conversion in the D7 strain of Saccharomyces cerevisiae was significantly enhanced by exposure to non-enzymatic browning reaction products. These products were formed during the heating of sugar (caramelization reaction) or sugar-amino acid mixtures (Maillard reaction) at temperatures normally used during the cooking of food. Several modulating factors of this convertogenic activity were identified. These factors included two main groups: (1) trace metals which are widely distributed in the environment; and (2) several cellular enzymatic systems. The convertogenic activities of a heated glucose-lysine mixture and a commercial caramel powder were completely suppresses when yeast were concurrently exposed to these products and to either FeIII or CuII. Equimolar concentrations of MnII or sodium selenite had no effect on the convertogenic activity of the products of either model system. Horse-radish peroxidase, beef liver catalase and rat liver S9 preparations each decreased the frequency of gene conversion induced by the caramel powder and the heated glucose-lysine products. This modulating activity of the enzymes was lost if they were heat-inactivated. These studies indicate the presence of a variety of protective mechanisms which can modify genotoxic components in complex food mixtures. PMID:7045641

  3. Study of reactions with neutron production in pp and pd collisions at 1 GeV

    SciTech Connect

    Baturin, V.N.; Koptev, V.P.; Maev, E.M.; Makarov, M.M.; Nelyubin, V.V.; Sulimov, V.V.; Khanzadeev, A.V.; Shcherbakov, G.V.

    1980-02-01

    Absolute doubly differential cross sections for production of neutrons of energy 350--1000 MeV on bombardment of hydrogen and deuterium with 1-GeV protons have been measured at angles 4, 7.5, 11.3, and 13.2/sup 0/. The neutron energy was determined by the time-of-flight method with utilization of the time microstructure of the accelerator beam. Cross sections for neutron production in reactions with meson production were obtained. It is noted that the dominant process in these reactions is the formation of the triangle-open(1232) isobar in the intermediate state. Cross sections for quasielastic knockout of neutrons from deuterium were determined. The contribution of spin-dependent amplitudes to the pn..-->..np charge-exchange cross section was estimated an an angle 0/sup 0/.

  4. Thermonuclear breakup reactions of light nuclei. II - Gamma-ray line production and other applications

    NASA Technical Reports Server (NTRS)

    Guessoum, Nidhal

    1989-01-01

    The main consequence of nuclear breakup reactions in high-temperature plasmas is shown to be to reduce the production of the gamma-ray lines, due to the breakup of these species at high temperature. Results of the emissivities of all the relevant gamma-ray lines are discussed. It is shown that the magnitude of the breakup effect on the line emissivities depends strongly on temperature, but more importantly on the plasma density and on the available time for the ion processes. Other effects considered include the production of neutrons (from the breakup of helium) and its consequences (such as the production of gamma rays from n-capture reactions and dynamical effects in accretion disk plasmas).

  5. Hydroxyl-radical production in physiological reactions. A novel function of peroxidase.

    PubMed

    Chen, S X; Schopfer, P

    1999-03-01

    Peroxidases catalyze the dehydrogenation by hydrogen peroxide (H2O2) of various phenolic and endiolic substrates in a peroxidatic reaction cycle. In addition, these enzymes exhibit an oxidase activity mediating the reduction of O2 to superoxide (O2.-) and H2O2 by substrates such as NADH or dihydroxyfumarate. Here we show that horseradish peroxidase can also catalyze a third type of reaction that results in the production of hydroxyl radicals (.OH) from H2O2 in the presence of O2.-. We provide evidence that to mediate this reaction, the ferric form of horseradish peroxidase must be converted by O2.- into the perferryl form (Compound III), in which the haem iron can assume the ferrous state. It is concluded that the ferric/perferryl peroxidase couple constitutes an effective biochemical catalyst for the production of .OH from O2.- and H2O2 (iron-catalyzed Haber-Weiss reaction). This reaction can be measured either by the hydroxylation of benzoate or the degradation of deoxyribose. O2.- and H2O2 can be produced by the oxidase reaction of horseradish peroxidase in the presence of NADH. The .OH-producing activity of horseradish peroxidase can be inhibited by inactivators of haem iron or by various O2.- and .OH scavengers. On an equimolar Fe basis, horseradish peroxidase is 1-2 orders of magnitude more active than Fe-EDTA, an inorganic catalyst of the Haber-Weiss reaction. Particularly high .OH-producing activity was found in the alkaline horseradish peroxidase isoforms and in a ligninase-type fungal peroxidase, whereas lactoperoxidase and soybean peroxidase were less active, and myeloperoxidase was inactive. Operating in the .OH-producing mode, peroxidases may be responsible for numerous destructive and toxic effects of activated oxygen reported previously. PMID:10103001

  6. Investigation of the use of Maillard reaction inhibitors for the production of patatin-carbohydrate conjugates.

    PubMed

    Seo, Sooyoun; Karboune, Salwa

    2014-12-17

    Selected Maillard reaction inhibitors, including aminoguanidine, cysteine, pyridoxamine, and sodium bisulfite, were evaluated for their effect on the production of carbohydrate conjugated proteins with less cross-linking/browning. Patatin (PTT), a major potato protein, was glycated with galactose, xylose, galactooligosaccharides, xylooligosaccharides, galactan, and xylan under controlled conditions. The effectiveness of the inhibitors to control the glycation reaction was assessed by monitoring the glycation extent, the protein cross-linking, and the formation of dicarbonyl compounds. Sodium bisulfite was the most effective inhibitor for PTT-galactose and PTT-xylan reaction systems (reaction control ratios of 210.0 and 12.8). On the other hand, aminoguanidine and cysteine led to the highest reaction control ratios for the PTT-xylose/xylooligosaccharide (160.0 and 143.0) and PTT-galactooligosaccharides/galactan (663.0 and 71.0) reaction systems, respectively. The use of cysteine and aminoguanidine as inhibitors led to 1.7-99.4% decreases in the particle size distribution of the PTT conjugates and to 0.4-9.3% increases in their relative digestibility, per 5% blocked lysine. PMID:25400165

  7. Ozone deposition velocities, reaction probabilities and product yields for green building materials

    NASA Astrophysics Data System (ADS)

    Lamble, S. P.; Corsi, R. L.; Morrison, G. C.

    2011-12-01

    Indoor surfaces can passively remove ozone that enters buildings, reducing occupant exposure without an energy penalty. However, reactions between ozone and building surfaces can generate and release aerosols and irritating and carcinogenic gases. To identify desirable indoor surfaces the deposition velocity, reaction probability and carbonyl product yields of building materials considered green (listed, recycled, sustainable, etc.) were quantified. Nineteen separate floor, wall or ceiling materials were tested in a 10 L, flow-through laboratory reaction chamber. Inlet ozone concentrations were maintained between 150 and 200 ppb (generally much lower in chamber air), relative humidity at 50%, temperature at 25 °C and exposure occurred over 24 h. Deposition velocities ranged from 0.25 m h -1 for a linoleum style flooring up to 8.2 m h -1 for a clay based paint; reaction probabilities ranged from 8.8 × 10 -7 to 6.9 × 10 -5 respectively. For all materials, product yields of C 1 thru C 12 saturated n-aldehydes, plus acetone ranged from undetectable to greater than 0.70 The most promising material was a clay wall plaster which exhibited a high deposition velocity (5.0 m h -1) and a low product yield (

  8. Effects of Reaction Product During Hydrogenation of Si Surfaces in HF Solution

    NASA Astrophysics Data System (ADS)

    Sugita, Yoshihiro; Watanabe, Satoru

    1998-03-01

    The reaction between the H-terminated Si surfaces and H2SiF6 solution, which is a reaction product of the dissolving SiO2 in the HF solution, was examined. The H2SiF6 solution selectively oxidized the mono-hydride on Si and degraded the hydrophobicity of the surface, while the di-hydride on Si remained stable in the solution. These results explained the crystal orientation dependence of the oxide removal from the Si surface.

  9. Heat of Combustion of the Product Formed by the Reaction of Acetylene, Ethylene, and Diborane

    NASA Technical Reports Server (NTRS)

    Tannenbaum, Stanley

    1957-01-01

    The net heat of combustion of the product formed by the reaction of diborane with a mixture of acetylene and ethylene was found to be 20,440 +/- 150 Btu per pound for the reaction of liquid fuel to gaseous carbon dioxide, gaseous water, and solid boric oxide. The measurements were made in a Parr oxygen-bomb calorimeter, and the combustion was believed to be 98 percent complete. The estimated net-heat of combustion for complete combustion would therefore be 20,850 +/- 150 Btu per pound.

  10. Production Cross Sections for Synthesis of Nuclides with Z = 118 IN Large Mass Transfer Reactions

    NASA Astrophysics Data System (ADS)

    Wang, Nan; Jin, Xin; Yang, Shuang; Zhao, En-Guang

    The production cross sections for the synthesis of superheavy nuclei with charge number 118 are studied with the di-nuclear system model with dynamical potential surface (DNS-DyPES model). The dynamical potential energy surface (PES) and the fusion probabilities for 48Ca bombarding Cf nuclei reactions are studied. By multiplying the capture cross section, fusion probability and survival probability, the evaporation residue(ER) cross sections for superheavy nuclei with Z = 118 are obtained. And the excitation functions for the reactions with a mixture target of Cf isotopes are also shown.

  11. Production of new heavy isotopes in low-energy multinucleon transfer reactions.

    PubMed

    Zagrebaev, Valery; Greiner, Walter

    2008-09-19

    It is shown that the multinucleon transfer reactions in low-energy collisions of heavy ions may be used for production of new neutron-rich nuclei at the "northeast" part of the nuclear map along the neutron closed shell N=126 which plays an important role in the r process of nucleosynthesis. More than 50 unknown nuclei might be produced in such reactions (in particular, in collision of 136Xe with 208Pb) with cross sections of not less than 1 microb. PMID:18851367

  12. Reactions of hydroxyl radical with humic substances: bleaching, mineralization, and production of bioavailable carbon substrates.

    PubMed

    Goldstone, J V; Pullin, M J; Bertilsson, S; Voelker, B M

    2002-02-01

    In this study, we examine the role of the hydroxyl (OH*) radical as a mechanism for the photodecomposition of chromophoric dissolved organic matter (CDOM) in sunlit surface waters. Using gamma-radiolysis of water, OH* was generated in solutions of standard humic substances in quantities comparable to those produced on time scales of days in sunlit surface waters. The second-order rate coefficients of OH* reaction with Suwannee River fulvic (SRFA; 2.7 x 10(4) s(-1) (mg of C/L)(-1)) and humic acids (SRHA; 1.9 x 10(4) s(-1) (mg of C/L)(-1)) are comparable to those observed for DOM in natural water samples and DOM isolates from other sources but decrease slightly with increasing OH* doses. OH* reactions with humic substances produced dissolved inorganic carbon (DIC) with a high efficiency of approximately 0.3 mol of CO2/mol of OH*. This efficiency stayed approximately constant from early phases of oxidation until complete mineralization of the DOM. Production rates of low molecular weight (LMW) acids including acetic, formic, malonic, and oxalic acids by reaction of SRFA and SRHA with OH* were measured using HPLC. Ratios of production rates of these acids to rates of DIC production for SRHA and for SRFA were similar to those observed upon photolysis of natural water samples. Bioassays indicated that OH* reactions with humic substances do not result in measurable formation of bioavailable carbon substrates other than the LMW acids. Bleaching of humic chromophores by OH* was relatively slow. Our results indicate that OH* reactions with humic substances are not likely to contribute significantly to observed rates of DOM photomineralization and LMW acid production in sunlit waters. They are also not likely to be a significant mechanism of photobleaching except in waters with very high OH* photoformation rates. PMID:11871550

  13. 40 CFR 721.9672 - Amides, tall-oil fatty, N-[2-[2-hydroxyethyl)amino]ethyl], reaction products with sulfur dioxide...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... Specific Chemical Substances § 721.9672 Amides, tall-oil fatty, N- ethyl], reaction products with sulfur... acids, tall-oil reaction products with sulfur dioxide and triethylenetetramine. (a) Chemical substance...], reaction products with sulfur dioxide; fatty acids, tall-oil, reaction products with...

  14. 40 CFR 721.9672 - Amides, tall-oil fatty, N-[2-[2-hydroxyethyl)amino]ethyl], reaction products with sulfur dioxide...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... Specific Chemical Substances § 721.9672 Amides, tall-oil fatty, N- ethyl], reaction products with sulfur... acids, tall-oil reaction products with sulfur dioxide and triethylenetetramine. (a) Chemical substance...], reaction products with sulfur dioxide; fatty acids, tall-oil, reaction products with...

  15. 40 CFR 721.9672 - Amides, tall-oil fatty, N-[2-[2-hydroxyethyl)amino]ethyl], reaction products with sulfur dioxide...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... Specific Chemical Substances § 721.9672 Amides, tall-oil fatty, N- ethyl], reaction products with sulfur... acids, tall-oil reaction products with sulfur dioxide and triethylenetetramine. (a) Chemical substance...], reaction products with sulfur dioxide; fatty acids, tall-oil, reaction products with...

  16. 40 CFR 721.9672 - Amides, tall-oil fatty, N-[2-[2-hydroxyethyl)amino]ethyl], reaction products with sulfur dioxide...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... Specific Chemical Substances § 721.9672 Amides, tall-oil fatty, N- ethyl], reaction products with sulfur... acids, tall-oil reaction products with sulfur dioxide and triethylenetetramine. (a) Chemical substance...], reaction products with sulfur dioxide; fatty acids, tall-oil, reaction products with...

  17. 40 CFR 721.9672 - Amides, tall-oil fatty, N-[2-[2-hydroxyethyl)amino]ethyl], reaction products with sulfur dioxide...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Specific Chemical Substances § 721.9672 Amides, tall-oil fatty, N- ethyl], reaction products with sulfur... acids, tall-oil reaction products with sulfur dioxide and triethylenetetramine. (a) Chemical substance...], reaction products with sulfur dioxide; fatty acids, tall-oil, reaction products with...

  18. comparative analysis of cellular respiratory inhibition by substituted phenylglyoxal-bis-(4-methyl-3-thiosemicarbazone) zinc chelates.

    PubMed

    Coats, E A; Milstein, S R; Pleiss, M A; Roesener, J A; Schmidt, J; McDonald, J; Reed, R

    1983-03-01

    Fourteen para-substituted phenylglyoxal-bis-(4-methyl-3-thiosemicarbazone) zinc chelates have been synthesized as inhibitors of cellular respiration and therefore as potential antineoplastic agents. Each chelate has been evaluated as an inhibitor of Ehrlich ascites tumor cell and of rat liver slice respiration. The molar I50 values for respiratory inhibition have been subjected to computerized correlation to delineate quantitative relationships between biological activity and chemical structure. Activity against the tumor cell model is characterized by a positive lipophilic and a detrimental steric influence while activity against rat liver slice displays only a weak positive lipophilic effect. Quantitative comparative analysis suggests that selective action against the tumor cell system can be improved by substituents which are electron withdrawing and lipophilic in nature. PMID:6852227

  19. The synthesis, molecular structure and photophysical properties of 2, 9, 16, 23-tetrakis (7-coumarinoxy-4-methyl)-phthalocyanine sensitizer

    NASA Astrophysics Data System (ADS)

    Guo, Jun-Jie; Wang, Shi-Rong; Li, Xiang-Gao; Zhang, Fei; Shao, Xiao-Na; Lian, Xi-Jun

    2014-02-01

    The synthesis, characterization, calculation, photophysical and thermal properties of 2, 9, 16, 23-tetrakis (7-coumarinoxy-4-methyl)-phthalocyanine are reported in this paper. The ground state absorbance suggests that an intramolecular color matching is formed between phthalocyanine and coumarin components. The fluorescence quantum yield (ΦF) of H2Pc-Cou is lower than Std-ZnPc for the flexibile coumarin units quenching more excited singlet state. The photoluminescence decays of the complex in DMF solution, in poly (methyl methacrylate) (PMMA) and on TiO2 films have been investigated with time-resolved emission. Density functional theory modeling of the structure and energy calculations is made at the same time. The thermal stability studies indicate that the complex is stable up to 376 °C. The photophysical properties and energy levels proved it can be employed as sensitizers for DSSC applications.

  20. Cytotoxic and Antitumour Studies of Acetoacetanilide N(4)-methyl(phenyl)thiosemicarbazone and its Transition Metal Complexes.

    PubMed

    Priya, N P; Firdous, A P; Jeevana, R; Aravindakshan, K K

    2015-01-01

    Cytotoxic activities of acetoacetanilide N(4)-methyl(phenyl)thiosemicarbazone (L2H) and its seven different metal complexes were studied. Of these, IC50 value of the copper complex was found to be 46 μg/ml. Antitumour studies of this copper complex was carried out using Daltons Lymphoma Ascites cell-induced solid tumour model and Ehrlich's Ascites Carcinoma cell-induced ascites tumour model. Administration of the copper complex at different concentrations (10, 5 and 1 mg/kg b. wt) inhibited the solid tumour development in mice and increased the mean survival rate and the life span of Ascites tumour bearing mice in a concentration dependent manner. PMID:26997691

  1. Cytotoxic and Antitumour Studies of Acetoacetanilide N(4)-methyl(phenyl)thiosemicarbazone and its Transition Metal Complexes

    PubMed Central

    Priya, N. P.; Firdous, A. P.; Jeevana, R.; Aravindakshan, K. K.

    2015-01-01

    Cytotoxic activities of acetoacetanilide N(4)-methyl(phenyl)thiosemicarbazone (L2H) and its seven different metal complexes were studied. Of these, IC50 value of the copper complex was found to be 46 μg/ml. Antitumour studies of this copper complex was carried out using Daltons Lymphoma Ascites cell-induced solid tumour model and Ehrlich's Ascites Carcinoma cell-induced ascites tumour model. Administration of the copper complex at different concentrations (10, 5 and 1 mg/kg b. wt) inhibited the solid tumour development in mice and increased the mean survival rate and the life span of Ascites tumour bearing mice in a concentration dependent manner. PMID:26997691

  2. Amino­[(1H-benzimidazol-2-yl)amino]­methaniminium 4-methyl­benzene­sulfonate

    PubMed Central

    Mohamed, Shaaban K.; Akkurt, Mehmet; Elremaily, Mahmoud A. A.; Ali, Ali. M.; Albayati, Mustafa R.

    2013-01-01

    The asymmetric unit of the title salt, C8H10N5 +·C7H7O3S−, consists of two amino­[(1H-benzimidazol-2-yl)amino]­meth­an­im­inium cations and two 4-methyl­benzene­sulfonate anions. The cations are each stabilized by intra­molecular N—H⋯N hydrogen bonds between the free amino groups and the imine N atoms of the benzimidazole units, forming S(6) ring motifs. In the crystal, cations and anions are linked by N—H⋯O and C—H⋯O hydrogen bonds, forming a three-dimensional supra­molecular framework. Two strong π–π stacking inter­actions [centroid–centroid distances = 3.4112 (14) and 3.4104 (14) Å] also occur between the centroids of the imidazole rings of like cations. PMID:24098229

  3. Study of ozone-initiated limonene reaction products by low temperature plasma ionization mass spectrometry.

    PubMed

    Nørgaard, Asger W; Vibenholt, Anni; Benassi, Mario; Clausen, Per Axel; Wolkoff, Peder

    2013-07-01

    Limonene and its ozone-initiated reaction products were investigated in situ by low temperature plasma (LTP) ionization quadrupole time-of-flight (QTOF) mass spectrometry. Helium was used as discharge gas and the protruding plasma generated ~850 ppb ozone in front of the glass tube by reaction with the ambient oxygen. Limonene applied to filter paper was placed in front of the LTP afterglow and the MS inlet. Instantly, a wide range of reaction products appeared, ranging from m/z 139 to ca. 1000 in the positive mode and m/z 115 to ca. 600 in the negative mode. Key monomeric oxidation products including levulinic acid, 4-acetyl-1-methylcyclohexene, limonene oxide, 3-isopropenyl-6-oxo-heptanal, and the secondary ozonide of limonene could be identified by collision-induced dissociation. Oligomeric products ranged from the nonoxidized dimer of limonene (C20H30) and up to the hexamer with 10 oxygen atoms (C60H90O10). The use of LTP for in situ ozonolysis and ionization represents a new and versatile approach for the assessment of ozone-initiated terpene chemistry. PMID:23666602

  4. Study of Ozone-Initiated Limonene Reaction Products by Low Temperature Plasma Ionization Mass Spectrometry

    NASA Astrophysics Data System (ADS)

    Nørgaard, Asger W.; Vibenholt, Anni; Benassi, Mario; Clausen, Per Axel; Wolkoff, Peder

    2013-07-01

    Limonene and its ozone-initiated reaction products were investigated in situ by low temperature plasma (LTP) ionization quadrupole time-of-flight (QTOF) mass spectrometry. Helium was used as discharge gas and the protruding plasma generated ~850 ppb ozone in front of the glass tube by reaction with the ambient oxygen. Limonene applied to filter paper was placed in front of the LTP afterglow and the MS inlet. Instantly, a wide range of reaction products appeared, ranging from m/ z 139 to ca. 1000 in the positive mode and m/ z 115 to ca. 600 in the negative mode. Key monomeric oxidation products including levulinic acid, 4-acetyl-1-methylcyclohexene, limonene oxide, 3-isopropenyl-6-oxo-heptanal, and the secondary ozonide of limonene could be identified by collision-induced dissociation. Oligomeric products ranged from the nonoxidized dimer of limonene (C20H30) and up to the hexamer with 10 oxygen atoms (C60H90O10). The use of LTP for in situ ozonolysis and ionization represents a new and versatile approach for the assessment of ozone-initiated terpene chemistry.

  5. Hexagonal boron nitride thin film thermal neutron detectors with high energy resolution of the reaction products

    NASA Astrophysics Data System (ADS)

    Doan, T. C.; Majety, S.; Grenadier, S.; Li, J.; Lin, J. Y.; Jiang, H. X.

    2015-05-01

    Hexagonal boron nitride (h-BN) is highly promising for solid-state thermal neutron detector applications due to its many outstanding physical properties, especially its very large thermal neutron capture cross-section (~3840 barns for 10B), which is several orders of magnitude larger than those of most other isotopes. The focus of the present work is to carry out studies on h-BN thin film and detector properties to lay the foundation for the development of a direct-conversion solid-state thermal neutron detector with high sensitivity. The measured carrier mobility-lifetime (μτ) product of h-BN thin films grown on sapphire substrates is 2.83×10-7 cm2/V for electrons and holes, which is comparable to the value of about 10-7 cm2/V for GaN thin films grown on sapphire. Detectors based on h-BN thin films were fabricated and the nuclear reaction product pulse height spectra were measured. Under a bias of 20 V, very narrow individual peaks corresponding to the reaction product energies of α and Li particles as well as the sum peaks have been clearly resolved in the pulse height spectrum for the first time by a B-based direct-conversion semiconductor neutron detector. Our results indicate that h-BN thin film detectors possess unique advantages including small size, low weight, portability, low voltage operation and high energy resolution of specific reaction products.

  6. Nucleon and triton production from nucleon-induced reactions on 7Li

    NASA Astrophysics Data System (ADS)

    Watanabe, Yukinobu; Guo, Hairui; Nagaoka, Kohei; Matsumoto, Takuma; Ogata, Kazuyuki; Yahiro, Masanobu

    2016-06-01

    Nucleon (N) and triton production from nucleon-induced reactions on 7Li at an incident energy of 14 MeV are analyzed by using three-body continuum discretized coupled channels method (CDCC), final state interaction (FSI) model, and sequential decay (SD) model. The CDCC is used to describe nucleon and triton production via breakup continuum channels, 7Li(N,N')7Li*→ t + α. Triton production from p(n) + 7Li → t + 5Li(5He) channel and nucleon production from sequential decay of the ground-state 5Li(5He) are calculated by the FSI model and the SD model, respectively. The calculated double differential cross sections for both nucleon and triton production are in good agreement with experimental ones except at relatively low nucleon emission energies.

  7. Markers of heterogeneous reaction products in α-pinene ozone secondary organic aerosol

    NASA Astrophysics Data System (ADS)

    Czoschke, Nadine M.; Jang, Myoseon

    A gas chromatograph iontrap mass spectrometer (GC-ITMS) was used to analyze the gas-and particle-phase products of α-pinene ozone oxidation in the presence of three different inorganic seed aerosols: sodium chloride, ammonium sulfate only, and ammonium sulfate with sulfuric acid. Products of α-pinene ozone oxidation common to the literature showed little difference in gas or particle-phase concentrations between seed types within the precision of the measurements even though significantly different aerosol yields were found between seed types. Small amounts of ring-opening products of four-membered cyclic oxygenates and markers of aldol condensation products were tentatively identified in the particle-phase for all seed types. These tentatively identified products are thought to be the result of acid-catalyzed heterogeneous reactions in the particle-phase or during sampling processes or analysis. The mechanisms for their formation are also proposed in this study.

  8. Experimental study of the reactions of limonene with OH and OD radicals: kinetics and products.

    PubMed

    Braure, Tristan; Bedjanian, Yuri; Romanias, Manolis N; Morin, Julien; Riffault, Véronique; Tomas, Alexandre; Coddeville, Patrice

    2014-10-01

    The kinetics of the reactions of limonene with OH and OD radicals has been studied using a low-pressure flow tube reactor coupled with a quadrupole mass spectrometer: OH + C10H16 → products (1), OD + C10H16 → products (2). The rate constants of the title reactions were determined using four different approaches: either monitoring the kinetics of OH (OD) radicals or limonene consumption in excess of limonene or of the radicals, respectively (absolute method), and by the relative rate method using either the reaction OH (OD) + Br2 or OH (OD) + DMDS (dimethyl disulfide) as the reference one and following HOBr (DOBr) formation or DMDS and limonene consumption, respectively. As a result of the absolute and relative measurements, the overall rate coefficients, k1 = (3.0 ± 0.5) × 10(-11) exp((515 ± 50)/T) and k2 = (2.5 ± 0.6) × 10(-11) exp((575 ± 60)/T) cm(3) molecule(-1) s(-1), were determined at a pressure of 1 Torr of helium over the temperature ranges 220-360 and 233-353 K, respectively. k1 was found to be pressure independent over the range 0.5-5 Torr. There are two possible pathways for the reaction between OH (OD) and limonene: addition of the radical to one of the limonene double bonds (reactions 1a and 2a ) and abstraction of a hydrogen atom (reactions 1b and 2b ), resulting in the formation of H2O (HOD). Measurements of the HOD yield as a function of temperature led to the following branching ratio of the H atom abstraction channel: k2b/k2 = (0.07 ± 0.03) × exp((460 ± 140)/T) for T = (253-355) K. PMID:25211148

  9. Use of Helium Production to Screen Glow Discharges for Low Energy Nuclear Reactions (LENR)

    NASA Astrophysics Data System (ADS)

    Passell, Thomas O.

    2011-03-01

    My working hypothesis of the conditions required to observe low energy nuclear reactions (LENR) follows: 1) High fluxes of deuterium atoms through interfaces of grains of metals that readily accommodate movement of hydrogen atoms interstitially is the driving variable that produces the widely observed episodes of excess heat above the total of all input energy. 2) This deuterium atom flux has been most often achieved at high electrochemical current densities on highly deuterium-loaded palladium cathodes but is clearly possible in other experimental arrangements in which the metal is interfacing gaseous deuterium, as in an electrical glow discharge. 3) Since the excess heat episodes must be producing the product(s) of some nuclear fusion reaction(s) screening of options may be easier with measurement of those ``ashes'' than the observance of the excess heat. 4) All but a few of the exothermic fusion reactions known among the first 5 elements produce He-4. Hence helium-4 appearance in an experiment may be the most efficient indicator of some fusion reaction without commitment on which reaction is occurring. This set of hypotheses led me to produce a series of sealed tubes of wire electrodes of metals known to absorb hydrogen and operate them for 100 days at the 1 watt power level using deuterium gas pressures of ~ 100 torr powered by 40 Khz AC power supplies. Observation of helium will be by measurement of helium optical emission lines through the glass envelope surrounding the discharge. The results of the first 18 months of this effort will be described.

  10. Product distributions, rate constants, and mechanisms of LiH +H reactions

    NASA Astrophysics Data System (ADS)

    Defazio, Paolo; Petrongolo, Carlo; Gamallo, Pablo; González, Miguel

    2005-06-01

    We present a quantum-mechanical investigation of the LiH depletion reaction LiH +H→Li+H2 and of the H exchange reaction LiH +H'→LiH'+H. We report product distributions, rate constant, and mechanism of the former, and rate constant and mechanism of the latter reaction. We use the potential-energy surface by Dunne et al. [Chem. Phys. Lett. 336, 1 (2001)], the real-wave-packet method by Gray and Balint-Kurti [J. Chem. Phys. 108, 950 (1998)], and the J-shifting approximation. The H21 nuclear-spin statistics and progressions of vib-rotational states (v',j') rule both initial-state-resolved and thermal product distributions, which have saw-toothed shapes with odd j' preferred with respect to even j'. At high collision energies and temperatures, we obtain a regular 3-to-1 intensity alternation of rotational states. At low collision energies and temperatures, the degeneracy and density of many H2 levels can, however, give more irregular distributions. During the collision, the energy flows from the reactant translational mode to the product vibration and recoil ones. The rate constants of both reactions are not Arrhenius type because the reactions are barrier-less. The low-temperature, LiH depletion rate constant is larger than the H exchange one, whereas the contrary holds at high temperature. The real-time mechanisms show the nuclear rearrangements of the nonreactive channel and of the reactive ones, and point out that the LiH depletion is preferred over the H exchange at short times. This confirms the rate-constant results.

  11. State-to-state mode selectivity in the HD + OH reaction: Perspectives from two product channels.

    PubMed

    Zhao, Bin; Sun, Zhigang; Guo, Hua

    2016-06-01

    The state-to-state quantum dynamics (Jtot = 0) of the HD + OH(υ2 = 0, 1) reaction is studied using a reactant coordinate based method, which allows the analysis of both the H + DOH and D + HOH channels with a single propagation. The stretching vibration of the newly formed bond, namely, the OD bond in DOH and one OH bond in HOH, is excited, thanks to its strong coupling with the reaction coordinate at the transition state. On the other hand, the vibrational energy deposited into the OH reactant (υ2 = 1) is sequestered during the reaction in the spectator OH mode. The combined effect leads to the excitation of both the OD and OH stretching modes in the DOH product, and the dominance of the (002) normal-mode state population in the HOH product, which in the local-mode picture corresponds to the excitation of both OH bonds with one quantum each. The energy flow in this prototypical tetratomic reaction can be understood in terms of the sudden vector projection model. PMID:27276953

  12. Mechanisms of Nitrogen Dioxide Reactions: Initiation of Lipid Peroxidation and the Production of Nitrous Acid

    NASA Astrophysics Data System (ADS)

    Pryor, William A.; Lightsey, John W.

    1981-10-01

    The reactions of nitrogen dioxide with cyclohexene have been studied as a model for the reactions that occur between nitrogen dioxide in smoggy air and unsaturated fatty acids in pulmonary lipids. As predicted from earlier studies at high nitrogen dioxide concentrations, this gas reacts with cyclohexene predominantly by addition to the double bond at nitrogen dioxide concentrations of I percent (10,000 parts per million) to 40 percent in nitrogen; in the presence of air or oxygen, this reaction initiates the autoxidation of the alkene. However, at concentrations below 100 parts per million in nitrogen, nitrogen dioxide reacts with cyclohexene almost exclusively by abstraction of allylic hydrogen; this unexpected reaction also initiates the autoxidation of the alkene in the presence of oxygen or air, but it leads to the production of nitrous acid rather than of a product containing a nitro group attached to a carbon atom. The nitrous acid can react with amines to produce nitrosamines. Moreover, the nitrite ion produced by the hydrogen abstraction mechanism would be expected to diffuse throughout the body, unlike nitrated lipids that would be confined to the pulmonary cavity. These findings have been confirmed with methyl oleate, linoleate, and linolenate; some of the kinetic features of the nitrogen dioxideinitiated autoxidation of these unsaturated fatty acids have been studied.

  13. Product analysis of the OH + NO/sub 2/ + M reaction

    SciTech Connect

    Burkholder, J.B.; Hammer, P.D.; Howard, C.J.

    1987-04-09

    A high-resolution Fourier transform spectrometer optically coupled to a fast flow multipass absorption cell was used to spectroscopically study the products of OH + NO/sub 2/ + M ..-->.. HONO/sub 2/ + M (1a) and OH + NO/sub 2/ + M ..-->.. HOONO + M (1b). Infrared absorption spectra of the products of reaction 1 were recorded over the range 1850-3850 cm/sup -1/ for the following conditions: pressure 3 to 850 Torr, temperature 248 to 298 K, and (OH)/sub 0/ = (5 to 100) x 10/sup 11/ molecules cm/sup -3/. The infrared absorption spectrum of HOONO was not observed under these conditions. If the OH stretch band strength of HOONO is equal to that of HONO/sub 2/ this indicates <5% HOONO formation in reaction 1. Quantitative measurements of the conversion of OH to HONO/sub 2/ show that 75/sup +25//sub -10/% of reaction 1 forms HONO/sub 2/. These results are compared with predictions of the branching ratio of reaction 1 obtained from statistical theory.

  14. Urea degradation by electrochemically generated reactive chlorine species: products and reaction pathways.

    PubMed

    Cho, Kangwoo; Hoffmann, Michael R

    2014-10-01

    This study investigated the transformation of urea by electrochemically generated reactive chlorine species (RCS). Solutions of urea with chloride ions were electrolyzed using a bismuth doped TiO2 (BiOx/TiO2) anode coupled with a stainless steel cathode at applied anodic potentials (Ea) of either +2.2 V or +3.0 V versus the normal hydrogen electrode. In NaCl solution, the current efficiency of RCS generation was near 30% at both potentials. In divided cell experiments, the pseudo-first-order rate of total nitrogen decay was an order of magnitude higher at Ea of +3.0 V than at +2.2 V, presumably because dichlorine radical (Cl2(-)·) ions facilitate the urea transformation primary driven by free chlorine. Quadrupole mass spectrometer analysis of the reactor headspace revealed that N2 and CO2 are the primary gaseous products of the oxidation of urea, whose urea-N was completely transformed into N2 (91%) and NO3(-) (9%). The higher reaction selectivity with respect to N2 production can be ascribed to a low operational ratio of free available chlorine to N. The mass-balance analysis recovered urea-C as CO2 at 77%, while CO generation most likely accounts for the residual carbon. In light of these results, we propose a reaction mechanism involving chloramines and chloramides as reaction intermediates, where the initial chlorination is the rate-determining step in the overall sequence of reactions. PMID:25219459

  15. Zeolite Membrane Reactor for Water Gas Shift Reaction for Hydrogen Production

    SciTech Connect

    Lin, Jerry Y.S.

    2013-01-29

    Gasification of biomass or heavy feedstock to produce hydrogen fuel gas using current technology is costly and energy-intensive. The technology includes water gas shift reaction in two or more reactor stages with inter-cooling to maximize conversion for a given catalyst volume. This project is focused on developing a membrane reactor for efficient conversion of water gas shift reaction to produce a hydrogen stream as a fuel and a carbon dioxide stream suitable for sequestration. The project was focused on synthesizing stable, hydrogen perm-selective MFI zeolite membranes for high temperature hydrogen separation; fabricating tubular MFI zeolite membrane reactor and stable water gas shift catalyst for membrane reactor applications, and identifying experimental conditions for water gas shift reaction in the zeolite membrane reactor that will produce a high purity hydrogen stream. The project has improved understanding of zeolite membrane synthesis, high temperature gas diffusion and separation mechanisms for zeolite membranes, synthesis and properties of sulfur resistant catalysts, fabrication and structure optimization of membrane supports, and fundamentals of coupling reaction with separation in zeolite membrane reactor for water gas shift reaction. Through the fundamental study, the research teams have developed MFI zeolite membranes with good perm-selectivity for hydrogen over carbon dioxide, carbon monoxide and water vapor, and high stability for operation in syngas mixture containing 500 part per million hydrogen sulfide at high temperatures around 500°C. The research teams also developed a sulfur resistant catalyst for water gas shift reaction. Modeling and experimental studies on the zeolite membrane reactor for water gas shift reaction have demonstrated the effective use of the zeolite membrane reactor for production of high purity hydrogen stream.

  16. Abrasion-ablation model for neutron production in heavy ion reactions

    NASA Technical Reports Server (NTRS)

    Cucinotta, Francis A.; Wilson, John W.; Townsend, Lawrence W.

    1995-01-01

    In heavy ion reactions, neutron production at forward angles is observed to occur with a Gaussian shape that is centered near the beam energy and extends to energies well above that of the beam. This paper presents an abrasion-ablation model for making quantitative predictions of the neutron spectrum. To describe neutrons produced from the abrasion step of the reaction where the projectile and target overlap, the authors use the Glauber model and include effects of final-state interactions. They then use the prefragment mass distribution from abrasion with a statistical evaporation model to estimate the neutron spectrum resulting from ablation. Measurements of neutron production from Ne and Nb beams are compared with calculations, and good agreement is found.

  17. Holliday intermediates and reaction by-products in FLP protein-promoted site-specific recombination.

    PubMed Central

    Meyer-Leon, L; Huang, L C; Umlauf, S W; Cox, M M; Inman, R B

    1988-01-01

    Holliday structures are formed and resolved by FLP protein during site-specific recombination. These structures have been isolated and are visualized in both native and partially denatured states by electron microscopy. No single-strand breaks are found within the junction, indicating that the structure results from a reciprocal exchange of strands. These structures have properties consistent with being reaction intermediates. Double-strand cleavage products and "Y structures" are also detected and appear to be by-products of the reaction. The Y structures are three-armed branched molecules with a covalently closed junction located at the FLP recombination target site. Models are discussed, suggesting that both of these novel structures are made by aberrant cleavages during formation and resolution of the Holliday intermediate. Images PMID:3065624

  18. Entropy production of a steady-growth cell with catalytic reactions

    NASA Astrophysics Data System (ADS)

    Himeoka, Yusuke; Kaneko, Kunihiko

    2014-10-01

    Cells generally convert external nutrient resources to support metabolism and growth. Understanding the thermodynamic efficiency of this conversion is essential to determine the general characteristics of cellular growth. Using a simple protocell model with catalytic reaction dynamics to synthesize the necessary enzyme and membrane components from nutrients, the entropy production per unit-cell-volume growth is calculated analytically and numerically based on the rate equation for chemical kinetics and linear nonequilibrium thermodynamics. The minimal entropy production per unit-cell growth is found to be achieved at a nonzero nutrient uptake rate rather than at a quasistatic limit as in the standard Carnot engine. This difference appears because the equilibration mediated by the enzyme exists only within cells that grow through enzyme and membrane synthesis. Optimal nutrient uptake is also confirmed by protocell models with many chemical components synthesized through a catalytic reaction network. The possible relevance of the identified optimal uptake to optimal yield for cellular growth is also discussed.

  19. Mutagenicity of Maillard browning reaction products from various nitrosated amino acid-glucose mixtures.

    PubMed

    Yen, G C; Lee, T C

    1988-01-01

    Ten different amino acid-glucose Maillard browning products before and after reaction with nitrite were evaluated by the Ames mutagenicity assay. No mutagenic response was observed in the methylene chloride extracts of any browning products tested before nitrosation. However, mutagenicity was showed in most of the browning mixtures, e.g., glycine-glucose, lysine-glucose (I), arginine-glucose, phenylalanine-glucose (II), and methionine-glucose after nitrosation when examined by Salmonella typhimurium strains TA98 and TA100 either with or without S-9 metabolic activation. Among the browning mixtures, (I) and (II) showed the greatest mutagenic activity after reaction with nitrite. The mutagenicity of lysine-glucose with nitrite was dependent on browning intensity, nitrosation pH, nitrosation time, nitrite level and blocking agents. PMID:3406207

  20. Amplification of Pressure Waves during Vibrational Equilibration of Excited Chemical Reaction Products

    SciTech Connect

    Tarver, C M

    2004-05-11

    The Non-Equilibrium Zeldovich - von Neumann - Doring (NEZND) theory of self-sustaining detonation identified amplification of pressure wavelets during equilibration of vibrationally excited reaction products in the reaction zone as the physical mechanism by which exothermic chemical energy release sustains detonation waves. This mechanism leads to the formation of the well-known, complex three-dimensional structure of a self-sustaining detonation wave. This amplification mechanism is postulated to be a general property of subsonic and supersonic reactive flows occurring during: shock to detonation transition (SDT); hot spot ignition and growth; deflagration to detonation transition (DDT); flame acceleration by shock or compression waves; and acoustic (sound) wave amplification. The existing experimental and theoretical evidence for pressure wave amplification by chemical energy release into highly vibrationally excited product molecules under these reactive flow conditions is reviewed in this paper.

  1. Serotonin Transporter Gene (SLC6A4) Methylation Associates With Neonatal Intensive Care Unit Stay and 3-Month-Old Temperament in Preterm Infants.

    PubMed

    Montirosso, Rosario; Provenzi, Livio; Fumagalli, Monica; Sirgiovanni, Ida; Giorda, Roberto; Pozzoli, Uberto; Beri, Silvana; Menozzi, Giorgia; Tronick, Ed; Morandi, Francesco; Mosca, Fabio; Borgatti, Renato

    2016-01-01

    Preterm birth and Neonatal Intensive Care Unit (NICU) stay are early adverse stressful experiences, which may result in an altered temperamental profile. The serotonin transporter gene (SLC6A4), which has been linked to infant temperament, is susceptible to epigenetic regulation associated with early stressful experience. This study examined a moderation model in which the exposure to NICU-related stress and SLC6A4 methylation moderated infant temperament at 3 months of age. SLC6A4 methylation at 20 CpG sites was quantified in preterm infants (N = 48) and full-term infants (N = 30) from Italian middle-class families. Results suggested that in preterm infants NICU-related stress might be associated with alterations of serotonergic tone as a consequence of SLC6A4 methylation, which in turn, might associate with temperamental difficulties assessed at 3 months of age. PMID:26822441

  2. Reaction Products of Unsaturated Polycarboxylic Acids and Sodium Hypophosphite for Improved Flame Resistance of Cotton-Containing Materials

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Reaction products of unsaturated polycarboxylic acids and sodium hypophosite were found to improve flame resistance of cellulosic materials as determined by the 45 degree flammability test for apparel textiles. The most effective product was that from the reaction of maleic acid with sodium hypopho...

  3. 40 CFR 721.10538 - Phosphonium, tetrakis(hydroxymethyl)-, chloride (1:1), reaction products with 1-tetradecanamine...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...)-, chloride (1:1), reaction products with 1-tetradecanamine and urea. 721.10538 Section 721.10538 Protection... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10538 Phosphonium, tetrakis(hydroxymethyl)-, chloride (1:1), reaction products with 1-tetradecanamine and urea....

  4. 40 CFR 721.9220 - Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction products of secondary alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9220 Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

  5. 40 CFR 721.9400 - Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction product of phenolic... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9400 Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

  6. 40 CFR 721.10472 - 1,3-Benzenedimethanamine, polymers with epichlorohydrin-polyethylene glycol reaction products.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10472 1,3-Benzenedimethanamine, polymers with epichlorohydrin-polyethylene glycol reaction products. (a) Chemical substance and... with epichlorohydrin-polyethylene glycol reaction products. 721.10472 Section 721.10472 Protection...

  7. 40 CFR 721.6181 - Fatty acid, reaction product with substituted oxirane, formaldehyde-phenol polymer glycidyl ether...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6181 Fatty acid, reaction product with substituted oxirane, formaldehyde... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Fatty acid, reaction product...

  8. 40 CFR 721.3830 - Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3830 Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic). (a) Chemical substance and significant... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Formaldehyde, reaction products...

  9. 40 CFR 721.10237 - Formaldehyde, polymers with acetone-phenol reaction products and phenol, sodium salts.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... acetone-phenol reaction products and phenol, sodium salts. (a) Chemical substance and significant new uses...-phenol reaction products and phenol, sodium salts. 721.10237 Section 721.10237 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  10. 40 CFR 721.10145 - Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Modified reaction products of alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10145 Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

  11. 40 CFR 721.6181 - Fatty acid, reaction product with substituted oxirane, formaldehyde-phenol polymer glycidyl ether...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6181 Fatty acid, reaction product with substituted oxirane, formaldehyde... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Fatty acid, reaction product...

  12. 40 CFR 721.10145 - Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Modified reaction products of alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10145 Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

  13. 40 CFR 721.10145 - Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Modified reaction products of alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10145 Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

  14. 40 CFR 721.9220 - Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction products of secondary alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9220 Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

  15. 40 CFR 721.6477 - Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with maleic...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... with ethoxylated fatty alcohols, reaction products with maleic anhydride. 721.6477 Section 721.6477... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6477 Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with...

  16. 40 CFR 721.3830 - Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3830 Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic). (a) Chemical substance and significant... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Formaldehyde, reaction products...

  17. 40 CFR 721.10664 - Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ..., reaction products with alkenoic acid alkyl esters and diamine (generic). 721.10664 Section 721.10664... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10664 Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine (generic)....

  18. 40 CFR 721.10136 - 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ...-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl)melamine (generic). 721.10136 Section 721.10136... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10136 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with...

  19. 40 CFR 721.10136 - 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl)melamine (generic). 721.10136 Section 721.10136... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10136 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with...

  20. 40 CFR 721.6477 - Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with maleic...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... with ethoxylated fatty alcohols, reaction products with maleic anhydride. 721.6477 Section 721.6477... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6477 Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with...

  1. 40 CFR 721.10145 - Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Modified reaction products of alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10145 Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

  2. 40 CFR 721.10481 - Siloxanes and Silicones, Me vinyl, hydroxy-terminated, reaction products with silica.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... vinyl, hydroxy-terminated, reaction products with silica. (a) Chemical substance and significant new..., hydroxy-terminated, reaction products with silica. 721.10481 Section 721.10481 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  3. 40 CFR 721.6477 - Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with maleic...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... with ethoxylated fatty alcohols, reaction products with maleic anhydride. 721.6477 Section 721.6477... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6477 Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with...

  4. 40 CFR 721.10482 - Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with silica.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10482 Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with silica. (a) Chemical substance and... vinyl, hydroxy-terminated, reaction products with silica. 721.10482 Section 721.10482 Protection...

  5. 40 CFR 721.10285 - Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, reaction products with 1...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10285 Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, reaction products with 1-piperazineethanamine. (a) Chemical substance...-dimethylethyl)phenol, reaction products with 1-piperazineethanamine. 721.10285 Section 721.10285 Protection...

  6. 40 CFR 721.5560 - Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz[c...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz oxaphosphorin-6-oxide. 721.5560 Section 721... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.5560 Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz...

  7. 40 CFR 721.5560 - Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz[c...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz oxaphosphorin-6-oxide. 721.5560 Section 721... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.5560 Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz...

  8. 40 CFR 721.10429 - Fatty acids, C18-unsatd., dimers, reaction products with 1-piperazineethanamine and tall-oil...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ..., reaction products with 1-piperazineethanamine and tall-oil fatty acids. 721.10429 Section 721.10429... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10429 Fatty acids, C18-unsatd., dimers, reaction products with 1-piperazineethanamine and tall-oil fatty...

  9. 40 CFR 721.10363 - Alkenoic acid, 2-methyl-, 2-oxiranylmethyl ester, reaction products with 4,4′ -methylenebis...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...-oxiranylmethyl ester, reaction products with 4,4â² -methylenebis (cyclohexanamine) (generic). 721.10363 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10363 Alkenoic acid, 2-methyl-, 2-oxiranylmethyl ester, reaction products with...

  10. 40 CFR 721.3830 - Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3830 Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic). (a) Chemical substance and significant... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Formaldehyde, reaction products...

  11. 40 CFR 721.10237 - Formaldehyde, polymers with acetone-phenol reaction products and phenol, sodium salts.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... acetone-phenol reaction products and phenol, sodium salts. (a) Chemical substance and significant new uses...-phenol reaction products and phenol, sodium salts. 721.10237 Section 721.10237 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  12. 40 CFR 721.10363 - Alkenoic acid, 2-methyl-, 2-oxiranylmethyl ester, reaction products with 4,4′ -methylenebis...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...-oxiranylmethyl ester, reaction products with 4,4â² -methylenebis (cyclohexanamine) (generic). 721.10363 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10363 Alkenoic acid, 2-methyl-, 2-oxiranylmethyl ester, reaction products with...

  13. 40 CFR 721.9220 - Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Reaction products of secondary alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9220 Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

  14. 40 CFR 721.9220 - Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction products of secondary alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9220 Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

  15. 40 CFR 721.6181 - Fatty acid, reaction product with substituted oxirane, formaldehyde-phenol polymer glycidyl ether...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6181 Fatty acid, reaction product with substituted oxirane, formaldehyde... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Fatty acid, reaction product...

  16. 40 CFR 721.10238 - Formaldehyde, polymers with acetone-phenol reaction products and phenol, potassium sodium salts.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10238 Formaldehyde, polymers with acetone-phenol reaction products and phenol, potassium sodium salts. (a) Chemical substance...-phenol reaction products and phenol, potassium sodium salts. 721.10238 Section 721.10238 Protection...

  17. 40 CFR 721.10429 - Fatty acids, C18-unsatd., dimers, reaction products with 1-piperazineethanamine and tall-oil...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ..., reaction products with 1-piperazineethanamine and tall-oil fatty acids. 721.10429 Section 721.10429... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10429 Fatty acids, C18-unsatd., dimers, reaction products with 1-piperazineethanamine and tall-oil fatty...

  18. 40 CFR 721.3830 - Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.3830 Formaldehyde, reaction products with an alkylated phenol and an aliphatic amine (generic). (a) Chemical substance and significant... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Formaldehyde, reaction products...

  19. 40 CFR 721.10145 - Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Modified reaction products of alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10145 Modified reaction products of alkyl alcohol, halogenated alkane, substituted epoxide, and amino...

  20. 40 CFR 721.10483 - Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... vinyl, hydroxy-terminated, reaction products with -modified silica. 721.10483 Section 721.10483... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10483 Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with -modified silica....

  1. 40 CFR 721.10664 - Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ..., reaction products with alkenoic acid alkyl esters and diamine (generic). 721.10664 Section 721.10664... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10664 Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine (generic)....

  2. 40 CFR 721.10538 - Phosphonium, tetrakis(hydroxymethyl)-, chloride (1:1), reaction products with 1-tetradecanamine...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...)-, chloride (1:1), reaction products with 1-tetradecanamine and urea. 721.10538 Section 721.10538 Protection... NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10538 Phosphonium, tetrakis(hydroxymethyl)-, chloride (1:1), reaction products with 1-tetradecanamine and urea....

  3. 40 CFR 721.10136 - 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ...-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl)melamine (generic). 721.10136 Section 721.10136... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10136 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with...

  4. 40 CFR 721.10237 - Formaldehyde, polymers with acetone-phenol reaction products and phenol, sodium salts.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... acetone-phenol reaction products and phenol, sodium salts. (a) Chemical substance and significant new uses...-phenol reaction products and phenol, sodium salts. 721.10237 Section 721.10237 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  5. 40 CFR 721.9220 - Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction products of secondary alkyl... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9220 Reaction products of secondary alkyl amines with a substituted benzenesulfonic acid and sulfuric...

  6. 40 CFR 721.9400 - Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Reaction product of phenolic... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9400 Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

  7. 40 CFR 721.10285 - Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, reaction products with 1...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10285 Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, reaction products with 1-piperazineethanamine. (a) Chemical substance...-dimethylethyl)phenol, reaction products with 1-piperazineethanamine. 721.10285 Section 721.10285 Protection...

  8. 40 CFR 721.6477 - Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with maleic...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... with ethoxylated fatty alcohols, reaction products with maleic anhydride. 721.6477 Section 721.6477... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6477 Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with...

  9. 40 CFR 721.10238 - Formaldehyde, polymers with acetone-phenol reaction products and phenol, potassium sodium salts.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10238 Formaldehyde, polymers with acetone-phenol reaction products and phenol, potassium sodium salts. (a) Chemical substance...-phenol reaction products and phenol, potassium sodium salts. 721.10238 Section 721.10238 Protection...

  10. 40 CFR 721.10483 - Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... vinyl, hydroxy-terminated, reaction products with -modified silica. 721.10483 Section 721.10483... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10483 Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with -modified silica....

  11. 40 CFR 721.6477 - Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with maleic...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... with ethoxylated fatty alcohols, reaction products with maleic anhydride. 721.6477 Section 721.6477... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.6477 Alkyl polycarboxylic acids, esters with ethoxylated fatty alcohols, reaction products with...

  12. 40 CFR 721.9400 - Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Reaction product of phenolic... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9400 Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

  13. 40 CFR 721.9400 - Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Reaction product of phenolic... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9400 Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

  14. 40 CFR 721.10363 - Alkenoic acid, 2-methyl-, 2-oxiranylmethyl ester, reaction products with 4,4′ -methylenebis...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...-oxiranylmethyl ester, reaction products with 4,4â² -methylenebis (cyclohexanamine) (generic). 721.10363 Section... CONTROL ACT SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10363 Alkenoic acid, 2-methyl-, 2-oxiranylmethyl ester, reaction products with...

  15. 40 CFR 721.10238 - Formaldehyde, polymers with acetone-phenol reaction products and phenol, potassium sodium salts.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10238 Formaldehyde, polymers with acetone-phenol reaction products and phenol, potassium sodium salts. (a) Chemical substance...-phenol reaction products and phenol, potassium sodium salts. 721.10238 Section 721.10238 Protection...

  16. 40 CFR 721.5560 - Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz[c...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz oxaphosphorin-6-oxide. 721.5560 Section 721... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.5560 Formaldehyde, polymer with (chloromethyl) oxirane and phenol, reaction products with 6H-dibenz...

  17. 40 CFR 721.10472 - 1,3-Benzenedimethanamine, polymers with epichlorohydrin-polyethylene glycol reaction products.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10472 1,3-Benzenedimethanamine, polymers with epichlorohydrin-polyethylene glycol reaction products. (a) Chemical substance and... with epichlorohydrin-polyethylene glycol reaction products. 721.10472 Section 721.10472 Protection...

  18. 40 CFR 721.10136 - 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl)melamine (generic). 721.10136 Section 721.10136... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10136 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with...

  19. 40 CFR 721.9400 - Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Reaction product of phenolic... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.9400 Reaction product of phenolic pentaerythritol tetraesters with fatty acid esters and oils, and...

  20. 40 CFR 721.10136 - 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...-hydroxyethyl ester, reaction products with hexakis(alkoxyalkyl)melamine (generic). 721.10136 Section 721.10136... SIGNIFICANT NEW USES OF CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10136 2-Propenoic acid, 2-methyl-, 2-hydroxyethyl ester, reaction products with...

  1. 40 CFR 721.10285 - Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, reaction products with 1...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10285 Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, reaction products with 1-piperazineethanamine. (a) Chemical substance...-dimethylethyl)phenol, reaction products with 1-piperazineethanamine. 721.10285 Section 721.10285 Protection...

  2. 40 CFR 721.10481 - Siloxanes and Silicones, Me vinyl, hydroxy-terminated, reaction products with silica.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... vinyl, hydroxy-terminated, reaction products with silica. (a) Chemical substance and significant new..., hydroxy-terminated, reaction products with silica. 721.10481 Section 721.10481 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT SIGNIFICANT NEW USES OF...

  3. 40 CFR 721.10482 - Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with silica.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... CHEMICAL SUBSTANCES Significant New Uses for Specific Chemical Substances § 721.10482 Siloxanes and Silicones, di-Me, Me vinyl, hydroxy-terminated, reaction products with silica. (a) Chemical substance and... vinyl, hydroxy-terminated, reaction products with silica. 721.10482 Section 721.10482 Protection...

  4. An Ionic Liquid Reaction and Separation Process for Production of Hydroxymethylfurfural from Sugars

    SciTech Connect

    Liu, Wei; Zheng, Feng; Li, Joanne; Cooper, Alan R.

    2014-01-01

    There has been world-wide interest to making plastics out of renewable biomass feedstock for recent years. Hydroxymethylfurfural (HMF) is viewed as an attractive alternate to terephthalic acid (TPA) for production of polyesters (PET) and polyamides. Conversion of sugars into HMF has been studied in numerous publications. In this work, a complete ionic liquid reaction and separation process is presented for nearly stoichiometric conversion of fructose into HMF. Different adsorbent materials are evaluated and silicalite material is demonstrated effective for isolation of 99% pure HMF from actual ionic liquid reaction mixtures and for recovery of the un-converted sugars and reaction intermediate along with the ionic liquid. Membrane-coated silicalite particles are prepared and studied for a practical adsorption process operated at low pressure drops but with separation performances comparable or better than the powder material. Complete conversion of fresh fructose feed into HMF in the recycled ionic liquid is shown under suitable reaction conditions. Stability of HMF product is characterized. A simplified process flow diagram is proposed based on these research results, and the key equipment such as reactor and adsorbent bed is sized for a plant of 200,000 ton/year of fructose processing capacity. The proposed HMF production process is much simpler than the current paraxylene (PX) manufacturing process from petroleum oil, which suggests substantial reduction to the capital cost and energy consumption be possible. At the equivalent value to PX on the molar basis, there can be a large gross margin for HMF production from fructose and/or sugars.

  5. Effects of arsenic incorporation on jarosite dissolution rates and reaction products

    NASA Astrophysics Data System (ADS)

    Kendall, Matthew R.; Madden, Andrew S.; Elwood Madden, Megan E.; Hu, Qinhong

    2013-07-01

    Batch dissolution experiments were undertaken on synthetic arsenojarosites at pH 2, pH 8, and in ultra-pure water to better understand the influence of As incorporation on the kinetics and reaction products of jarosite dissolution. Incongruent jarosite dissolution was observed in all experiments. Arsenojarosite lacks the pH dependency observed in K-jarosite dissolution, likely the result of surface arsenate-iron complexes preventing protonation at low pH and repelling hydroxyls at high pH. The stronger bonding of arsenate to iron, compared to sulfate to iron, leads to an enrichment of surface layer arsenate-iron complex sites, inhibiting the dissolution of jarosite with time. The secondary reaction products formed during the dissolution of arsenojarosite include maghemite, goethite, and hematite in ultra-pure water, and ferrihydrite in pH 8 Tris buffered solution. Maghemite initially forms and transitions to hematite with time in ultra-pure water, but increasing arsenic concentrations slow this transition. At pH >3.5, arsenic from the dissolution of arsenojarosite adsorbs onto newly formed reaction products. Arsenic also inhibits the formation of goethite and reduces the crystallinity of the observed maghemite reaction products. The coprecipitation of iron oxides with increasing amounts of arsenic results in a change from spherical to "worm-like" aggregate morphology and provides a sink for arsenic released during arsenojarosite dissolution. This study shows that in open systems with a flush of fresh solution, arsenic incorporation in jarosite results in an increase in dissolution rates. In closed systems, however, increasing surface arsenate-iron complexes inhibit further dissolution of the underlying bulk material, causing a reduction in dissolution rates as arsenic incorporation increases.

  6. Jet production and high p/sub T/ phenomena in photon-photon reactions

    SciTech Connect

    Wermes, N.

    1983-05-01

    The status of experimental investigations of high p/sub T/ phenomena and jet production in photon-photon collisions is reviewed. Taking the challenging questions on hard scattering processes in ..gamma gamma.. reactions as a guide, the experimental approach to these questions is summarized. Results from the PETRA experiments CELLO, JADE, PLUTO, and TASSO are presented including preliminary results on the Q/sup 2/-dependence of jet cross sections. Experimental limitations and background problems are discussed. 36 references.

  7. Reaction by-products from high energy electron irradiation of aqueous solutions of trihalomethanes

    SciTech Connect

    Cadavid, E.M.; Cooper, W.J.; Nickelsen, M.G. ); Kurucz, C.N.; Waite, T.D. )

    1990-01-01

    Trihalomethanes (THMs) are formed in water when chlorine is used for disinfection. The THMs of interest are chloroform, bromodichloromethane, chlorodibromomethane and bromoform. This study was undertaken to study the removal of the trihalomethanes using an innovative treatment technique, high energy electrons, for drinking water treatment. In addition to removal studies experiments were undertaken at low radiation doses to determine whether other chlorinated compounds are formed as reaction by-products.

  8. Biodiesel Fuel Production by the Transesterification Reaction of Soybean Oil Using Immobilized Lipase

    NASA Astrophysics Data System (ADS)

    Bernardes, Otávio L.; Bevilaqua, Juliana V.; Leal, Márcia C. M. R.; Freire, Denise M. G.; Langone, Marta A. P.

    The enzymatic alcoholysis of soybean oil with methanol and ethanol was investigated using a commercial, immobilized lipase (Lipozyme RM IM). The effect of alcohol (methanol or ethanol), enzyme concentration, molar ratio of alcohol to soybean oil, solvent, and temperature on biodiesel production was determined. The best conditions were obtained in a solvent-free system with ethanol/oil molar ratio of 3.0, temperature of 50°C, and enzyme concentration of 7.0% (w/w). Three-step batch ethanolysis was most effective for the production of biodiesel. Ethyl esters yield was about 60% after 4 h of reaction.

  9. Maillard reaction products as "natural antibrowning" agents in fruit and vegetable technology.

    PubMed

    Billaud, Catherine; Maraschin, Christelle; Chow, Yin-Naï; Chériot, Sophie; Peyrat-Maillard, Marie-Nöelle; Nicolas, Jacques

    2005-07-01

    The effects of Maillard reaction products (MRPs), synthesized from a sugar (pentose, hexose, or disaccharide) and either a cysteine-related compound, an amino acid, or a sulfur compound, were investigated on polyphenoloxidase (PPO) activity from apple, mushroom, and eggplant. The optimal conditions for the production of inhibitory MRPs were performed using two-factor and five-level central experimental designs. It resulted that thiol-derived MRPs were highly prone to give rise to inhibitory compounds of PPO activity. Technological assays were also performed to test the efficiency of selected MRPs in the prevention of enzymatic browning in raw and minimally processed fruits and vegetables. PMID:15830337

  10. Products of the OH radical-initiated reactions of 2- and 3-hexyl nitrate

    NASA Astrophysics Data System (ADS)

    Aschmann, Sara M.; Arey, Janet; Atkinson, Roger

    2012-01-01

    Products of the gas-phase reaction of OH radicals with 2-hexyl nitrate (containing 13% 3-hexyl nitrate) have been investigated by gas chromatography with mass spectral and flame ionization detection, and by direct air sampling atmospheric pressure ionization tandem mass spectrometry. The products identified and quantified from 2-hexyl nitrate were: 2-hexanone (8.6 ± 1.3%), propanal (3.4 ± 0.8%), butanal (2.3 ± 0.6%) and 5-hydroxy-2-hexanone (25%), where the molar yields are given in parentheses. 3-Hexanone was observed from the 3-hexyl nitrate reaction, with a molar formation yield of 9.5 ± 2.1%. Organic nitrates of molecular weight 133, 161, 177 and 208 were also observed, and these are attributed to C 4-carbonyl nitrate(s), C 6-carbonyl-nitrates, C 6-hydroxycarbonyl-nitrates and C 6-dinitrates, respectively, and are expected to account for all or most of the non-quantified reaction products from OH + 2- and 3-hexyl nitrate. 5-Hydroxy-2-hexanone formation indicates that the CH 3CH(ONO 2)CH 2CH 2CH(O rad )CH 3 alkoxy radical dominantly reacts by isomerization.

  11. Gas-Phase Reactions of Methoxyphenols with NO3 Radicals: Kinetics, Products, and Mechanisms.

    PubMed

    Zhang, Haixu; Yang, Bo; Wang, Youfeng; Shu, Jinian; Zhang, Peng; Ma, Pengkun; Li, Zhen

    2016-03-01

    Methoxyphenols, a group of important tracers for wood smoke, are emitted to the atmosphere in large quantities, but their transformations are rarely studied. In this study, the kinetics and products of the gas-phase reactions of eugenol and 4-ethylguaiacol with NO3 radicals were investigated online using a vacuum ultraviolet photoionization gas time-of-flight mass spectrometer. The rate coefficients of the gaseous reactions of eugenol and 4-ethylguaiacol with NO3 radicals were (1.6 ± 0.4) × 10(-13) and (1.1 ± 0.2) × 10(-12) cm(3) molecule(-1) s(-1) (at 298 K), indicating that the atmospheric lifetimes of the NO3 radicals were 3.5 and 0.5 h, respectively. With the aid of gas-chromatography-mass-spectrometry analysis, several types of degradation products were identified with nitro derivatives as the major products. The configurations of the nitro-product isomers and their formation mechanisms were determined via theoretical calculations. On the basis of these products, degradation pathways of the methoxyphenols with NO3 radicals were proposed. This study determines the degradation rates and mechanisms of the methoxyphenols at night and implies the significant NO3 nighttime chemistry. PMID:26845070

  12. Reaction products of amido-amine and epoxide useful as fuel additives

    SciTech Connect

    Efner, H.F.

    1988-04-12

    A method for reducing engine deposits in an internal combustion engine is described comprising the addition of a detergent fuel additive package to a hydrocarbon fuel for the engine. The fuel detergent is added in an amount effective to reduce deposits and the hydrocarbon fuel is used with detergent additive as fuel in an internal combustion engine. The detergent fuel additive package comprises: (1) a fuel detergent additive that is the reaction product prepared by reacting (a) vegetable oil or (b) higher carboxylic acid chosen from (i) aliphatic fatty acids having 10-25 carbon atoms and (ii) aralkyl acids having 12-42 carbon atoms with (c) multiamine to obtain a fist product mixture with the first product mixture reacted with alklylene oxide to produce a second product mixture and (2) a fuel detergent additive solvent compatible with the fuels.

  13. N,N'-(Hexane-1,6-diyl)bis(4-methyl-N-(oxiran-2-ylmethyl)benzenesulfonamide): Synthesis via cyclodextrin mediated N-alkylation in aqueous solution and further Prilezhaev epoxidation

    PubMed Central

    Fischer, Julian; Millan, Simon

    2013-01-01

    Summary N-alkylation of N,N'-(hexane-1,6-diyl)bis(4-methylbenzenesulfonamide) with allyl bromide and subsequent Prilezhaev reaction with m-chloroperbenzoic acid to give N,N'-(hexane-1,6-diyl)bis(4-methyl-N-(oxiran-2-ylmethyl)benzenesulfonamide) is described. This twofold alkylation was performed in aqueous solution, whereby α-, and randomly methylated β-cyclodextrin were used as adequate phase transfer catalysts and the cyclodextrin–guest complexes were characterized by 1H NMR and 2D NMR ROESY spectroscopy. Finally, the curing properties of the diepoxide with lysine-based α-amino-ε-caprolactam were analyzed by rheological measurements. PMID:24367447

  14. Large-Scale Refolding and Enzyme Reaction of Human Preproinsulin for Production of Human Insulin.

    PubMed

    Kim, Chang-Kyu; Lee, Seung-Bae; Son, Young-Jin

    2015-10-28

    Human insulin is composed of 21 amino acids of an A-chain and 30 amino acids of a B-chain. This is the protein hormone that has the role of blood sugar control. When the recombinant human proinsulin is expressed in Escherichia coli, a serious problem is the formation of an inclusion body. Therefore, the inclusion body must be denatured and refolded under chaotropic agents and suitable reductants. In this study, H27R-proinsulin was refolded from the denatured form with β-mercaptoethanol and urea. The refolding reaction was completed after 15 h at 15°C, whereas the reaction at 25°C was faster than that at 15°C. The refolding yield at 15°C was 17% higher than that at 25°C. The refolding reaction could be carried out at a high protein concentration (2 g/l) using direct refolding without sulfonation. The most economical and optimal refolding condition for human preproinsulin was 1.5 g/l protein, 10 mM glycine buffer containing 0.6 M urea, pH 10.6, and 0.3 mM β-mercaptoethanol at 15°C for 16 h. The maximum refolding yield was 74.8% at 15°C with 1.5 g/l protein. Moreover, the refolded preproinsulin could be converted into normal mature insulin with two enzymes. The average amount of human insulin was 138.2 g from 200 L of fermentation broth after enzyme reaction with H27R-proinsulin. The direct refolding process for H27R-proinsulin was successfully set up without sulfonation. The step yields for refolding and enzyme reaction were comparatively high. Therefore, our refolding process for production of recombinant insulin may be beneficial to the large-scale production of other biologically active proteins. PMID:26139616

  15. Product Branching Ratios of the Reaction of CO with H-3(+) and H2D+

    SciTech Connect

    Yu, H.G.

    2009-11-20

    The reaction of CO with H{sub 3}{sup +} and H{sub 2}D{sup +} has been studied to investigate thermal rate coefficients and product branching ratios in the temperature range [20, 350] K, by using a direct ab initio molecular dynamics method. In trajectory simulations, the energies and forces are calculated using a scaling all correlation second-order Moeller-Plesset perturbation theory (SAC-MP2) method with the correlation consistent polarized valence triplet-zeta basis (cc-pVTZ). Results show that total thermal rate coefficients for both the CO + H{sub 3}{sup +}and the CO + H{sub 2}D{sup +} reactions have a weakly positive temperature dependence. At room temperature, the rate coefficients are predicted to be (1.42 {+-} 0.03) x 10{sup -9} cm{sup 3} molecule{sup -1} s{sup -1} with a product branching ratio of [HOC{sup +}]/[HCO{sup +}] = 0.36 {+-} 0.01 for the CO + H{sub 3}{sup +} reaction, and (1.26 {+-} 0.03) x 10{sup -9} cm{sup 3} molecule{sup -1} s{sup -1} with the product branching ratios: 0.37 {+-} 0.01 (([HOC{sup +}] + [DOC{sup +}])/([HCO{sup +}] + [DOC{sup +}])), 0.54 {+-} 0.02 ([DCO{sup +}]/[HCO{sup +}]), and 0.49 {+-} 0.02 ([DOC{sup +}]/[HOC{sup +}]) for CO + H{sub 2}D{sup +}. The product branching ratios have a noticeable temperature dependence as well as a pronounced isotopic effect for the H/DOC{sup +} product channel.

  16. Production of heavy and superheavy neutron-rich nuclei in transfer reactions

    SciTech Connect

    Zagrebaev, V. I.; Greiner, Walter

    2011-04-15

    The problem of production and study of heavy neutron-rich nuclei has been intensively discussed during recent years. Many reasons arouse a great interest in this problem. The present limits of the upper part of the nuclear map are very close to the {beta} stability line while the unexplored area of heavy neutron-rich nuclides (also those located along the neutron closed shell N=126 to the right-hand side of the stability line) is extremely important for nuclear astrophysic investigations and, in particular, for the understanding of the r process of astrophysical nucleogenesis. For elements with Z>100 only neutron deficient isotopes (located to the left of the stability line) have been synthesized so far. The 'northeast' area of the nuclear map can be reached neither in fusion-fission reactions nor in fragmentation processes widely used nowadays for the production of new nuclei. Multinucleon transfer processes in near barrier collisions of heavy (and very heavy, U-like) ions seem to be the only reaction mechanism allowing us to produce and explore neutron-rich heavy nuclei including those located at the superheavy island of stability. In this paper several transfer reactions for different projectile-target combinations are studied in detail. Besides the predictions for the cross sections of such processes, we also analyze the angular and energy distributions of primary and survived reaction products in the laboratory frame. These results, as well as predicted excitation functions for the yields of neutron-rich superheavy isotopes, might be useful for the design of appropriate experimental equipment and for carrying out experiments of such kind.

  17. ASR prevention — Effect of aluminum and lithium ions on the reaction products

    SciTech Connect

    Leemann, Andreas; Alahrache, Salaheddine; Winnefeld, Frank

    2015-10-15

    In spite of the recent progress in the understanding of the mechanisms enabling aluminum-containing SCM like metakaolin and added LiNO{sub 3} to limit the extent of ASR in mortar and concrete, some gaps still remain. They concern mainly the effect of aluminum-containing SCM on the formed ASR products and the influence of aggregate characteristics on the effectiveness of LiNO{sub 3}. In this study, a model system, concrete and mortar were investigated by pore solution analysis, TGA, XRD, NMR, SEM combined with EDX and ToF-SIMS to address these questions. The amount of aluminum present in the pore solution of concrete and mortar is only able to slow down SiO{sub 2} dissolution but not to alter morphology, structure and composition of the reaction products. LiNO{sub 3} can suppress ASR by forming dense products protecting reactive minerals from further reaction. But its effectiveness is decreasing with increasing specific surface area of the reactive minerals in aggregates. - Highlights: • Aluminum of SCM slows down SiO{sub 2} dissolution. • Aluminum of SCM does not alter morphology and structure of ASR product. • ASR suppressing effect of LiNO{sub 3} depends on specific surface area of the aggregates.

  18. Comparison of complementary reactions for the production of {sup 261,262}Bh

    SciTech Connect

    Nelson, S. L.; Folden III, C. M.; Dragojevic, I.; Garcia, M. A.; Gates, J. M.; Nitsche, H.; Gregorich, K. E.; Sudowe, R.; Duellmann, Ch. E.; Eichler, R.

    2008-08-15

    Two heavy-ion induced fusion reactions producing {sup 261,262}Bh were studied using the Berkeley Gas-filled Separator at the Lawrence Berkeley National Laboratory 88-Inch Cyclotron. An excitation function for the production of {sup 262}Bh via the reaction {sup 209}Bi({sup 54}Cr,n){sup 262}Bh was measured with a maximum cross section from a fit to the data of 430 {+-} 110 pb observed at a compound nucleus excitation energy of 15.7 MeV. New data have been measured for the 1n exit channel of the {sup 208}Pb({sup 55}Mn, n){sup 262}Bh reaction. We present an updated excitation function with an observed maximum cross section of 530{+-}100 pb at a compound nucleus excitation energy of 14.1 MeV. Events corresponding to the 2n exit channel for the {sup 209}Bi({sup 54}Cr,2n){sup 261}Bh and {sup 208}Pb({sup 55}Mn,2n){sup 261}Bh reactions were also observed and are presented as partial excitation functions. The measured decay properties correspond well with existing experimental data. We compare these experimental results to cross section predictions from a model by Swiatecki et al. and discuss entrance channel effects on the magnitude of 1n cross sections.

  19. Structural Analysis of Substrate, Reaction Intermediate, and Product Binding in Haemophilus influenzae Biotin Carboxylase

    PubMed Central

    Broussard, Tyler C.; Pakhomova, Svetlana; Neau, David B.; Bonnot, Ross; Waldrop, Grover L.

    2015-01-01

    Acetyl-CoA carboxylase catalyzes the first and regulated step in fatty acid synthesis. In most Gram-negative and Gram-positive bacteria, the enzyme is composed of three proteins: biotin carboxylase, a biotin carboxyl carrier protein (BCCP), and carboxyltransferase. The reaction mechanism involves two half-reactions with biotin carboxylase catalyzing the ATP-dependent carboxylation of biotin-BCCP in the first reaction. In the second reaction, carboxyltransferase catalyzes the transfer of the carboxyl group from biotin-BCCP to acetyl-CoA to form malonyl-CoA. In this report, high-resolution crystal structures of biotin carboxylase from Haemophilus influenzae were determined with bicarbonate, the ATP analogue AMPPCP; the carboxyphosphate intermediate analogues, phosphonoacetamide and phosphonoformate; the products ADP and phosphate; and the carboxybiotin analogue N1′-methoxycarbonyl biotin methyl ester. The structures have a common theme in that bicarbonate, phosphate, and the methyl ester of the carboxyl group of N1′-methoxycarbonyl biotin methyl ester all bound in the same pocket in the active site of biotin carboxylase and as such utilize the same set of amino acids for binding. This finding suggests a catalytic mechanism for biotin carboxylase in which the binding pocket that binds tetrahedral phosphate also accommodates and stabilizes a tetrahedral dianionic transition state resulting from direct transfer of CO2 from the carboxyphosphate intermediate to biotin. PMID:26020841

  20. Structural Analysis of Substrate, Reaction Intermediate, and Product Binding in Haemophilus influenzae Biotin Carboxylase.

    PubMed

    Broussard, Tyler C; Pakhomova, Svetlana; Neau, David B; Bonnot, Ross; Waldrop, Grover L

    2015-06-23

    Acetyl-CoA carboxylase catalyzes the first and regulated step in fatty acid synthesis. In most Gram-negative and Gram-positive bacteria, the enzyme is composed of three proteins: biotin carboxylase, a biotin carboxyl carrier protein (BCCP), and carboxyltransferase. The reaction mechanism involves two half-reactions with biotin carboxylase catalyzing the ATP-dependent carboxylation of biotin-BCCP in the first reaction. In the second reaction, carboxyltransferase catalyzes the transfer of the carboxyl group from biotin-BCCP to acetyl-CoA to form malonyl-CoA. In this report, high-resolution crystal structures of biotin carboxylase from Haemophilus influenzae were determined with bicarbonate, the ATP analogue AMPPCP; the carboxyphosphate intermediate analogues, phosphonoacetamide and phosphonoformate; the products ADP and phosphate; and the carboxybiotin analogue N1'-methoxycarbonyl biotin methyl ester. The structures have a common theme in that bicarbonate, phosphate, and the methyl ester of the carboxyl group of N1'-methoxycarbonyl biotin methyl ester all bound in the same pocket in the active site of biotin carboxylase and as such utilize the same set of amino acids for binding. This finding suggests a catalytic mechanism for biotin carboxylase in which the binding pocket that binds tetrahedral phosphate also accommodates and stabilizes a tetrahedral dianionic transition state resulting from direct transfer of CO₂ from the carboxyphosphate intermediate to biotin. PMID:26020841