Shock Tube Measurement of the High-Temperature Rate Constant for OH + CH3 → Products

被引:8
|
作者
Wang, Shengkai [1 ]
Li, Sijie [1 ]
Davidson, David F. [1 ]
Hanson, Ronald K. [1 ]
机构
[1] Stanford Univ, Dept Mech Engn, High Temp Gasdynam Lab, Stanford, CA 94305 USA
来源
JOURNAL OF PHYSICAL CHEMISTRY A | 2015年 / 119卷 / 33期
关键词
METHYL RADICALS; REACTION CH3+OH; N-HEPTANE; ABSORPTION; ACETONE; DISSOCIATION; PRESSURE; RECOMBINATION; DEPENDENCE; 2-BUTANONE;
D O I
10.1021/acs.jpca.5b05725
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The reaction between hydroxyl (OH) and methyl radicals (CH,) is critical to hydrocarbon oxidation. Motivated by the sparseness of its high-temperature rate constant data and the large uncertainties in the existing literature values, the current study has remeasured the overall rate constant of the OH + CH3 reaction and extended the measurement temperature range to 1214-1933 K, using simultaneous laser absorption diagnostics for OH and CH3 radicals behind incident and reflected shock waves. ten-Butyl hydroperoxide and azomethane were used as pyrolytic sources for the OH and CH3 radicals, respectively. The current study bridged the temperature ranges of existing experimental data, and good agreement is seen between the current measurement and some previous experimental and theoretical high-temperature studies. A recommendation for the rate constant expression of the title reaction, based on the weighted average of the high-temperature data from selected studies, is given by k(1) = 4.19 X 10(1)(T/K)(3.15) exp(5270 K/T) cm(3) mol(-1) s(-1) +/- 30%, which is valid over 1000-2500 K
引用
收藏
页码:8799 / 8805
页数:7
相关论文
共 50 条
  • [21] RATE CONSTANT FOR CH2(B-3(1)+CH3
    PILLING, MJ
    ROBERTSON, JA
    CHEMICAL PHYSICS LETTERS, 1975, 33 (02) : 336 - 339
  • [22] Experimental Determination of the High-Temperature Rate Constant for the Reaction of OH with sec-Butanol
    Pang, Genny A.
    Hanson, Ronald K.
    Golden, David M.
    Bowman, Craig T.
    JOURNAL OF PHYSICAL CHEMISTRY A, 2012, 116 (39): : 9607 - 9613
  • [23] HIGH-TEMPERATURE PHASE-TRANSITIONS IN (CH3)4NCL
    ALBERT, S
    RIPMEESTER, JA
    JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (07): : 2870 - 2873
  • [24] SHOCK TUBE IN HIGH-TEMPERATURE CHEMICAL PHYSICS
    WALLIS, G
    ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-LEIPZIG, 1965, 228 (3-4): : 282 - &
  • [25] Uncertainty quantification in the ab initio rate-coefficient calculation for the CH3CH(OH)CH3 + OH → CH3C•(OH)CH3 + H2O reaction
    Prager, Jens
    Najm, Habib N.
    Zador, Judit
    PROCEEDINGS OF THE COMBUSTION INSTITUTE, 2013, 34 : 583 - 590
  • [26] RATE-CONSTANT OF UNIMOLECULAR DECOMPOSITION OF THE RADICAL (CH3)2CCH(CH3)2
    GORGENYI, M
    SERES, L
    REACTION KINETICS AND CATALYSIS LETTERS, 1992, 48 (02): : 379 - 384
  • [27] High-temperature rate constants for CH3OCOH + OH reactions: the effects of multiple structures and paths
    Igor Araujo Lins
    Maiara Oliveira Passos
    Tiago Vinicius Alves
    Theoretical Chemistry Accounts, 2020, 139
  • [28] High-temperature rate constants for CH3OCOH + OH reactions: the effects of multiple structures and paths
    Lins, Igor Araujo
    Passos, Maiara Oliveira
    Alves, Tiago Vinicius
    THEORETICAL CHEMISTRY ACCOUNTS, 2020, 139 (04)
  • [29] High-Temperature Shock Tube Measurements of Dimethyl Ether Decomposition and the Reaction of Dimethyl Ether with OH
    Cook, Robert D.
    Davidson, David F.
    Hanson, Ronald K.
    JOURNAL OF PHYSICAL CHEMISTRY A, 2009, 113 (37): : 9974 - 9980
  • [30] A high-temperature shock tube kinetic study for the branching ratios of isobutene plus OH reaction
    Khaled, Fethi
    Giri, Binod Raj
    Farooq, Aamir
    PROCEEDINGS OF THE COMBUSTION INSTITUTE, 2017, 36 (01) : 265 - 272