MECHANISTIC MODELING OF THE PYROLYSIS OF NORMAL-HEXANE

被引:8
作者
BILLAUD, F
ELYAHYAOUI, K
BARONNET, F
机构
[1] Département de Chimie Physique des Réactions, URA n0328 CNRS, INPL - ENSIC, 54001 Nancy
关键词
FREE RADICAL CHAIN MECHANISM; NORMAL-HEXANE; MECHANISTIC MODEL; PYROLYSIS;
D O I
10.1016/0165-2370(91)80033-5
中图分类号
O65 [分析化学];
学科分类号
070302 ; 081704 ;
摘要
A mechanistic model of the thermal decomposition reactions of n-hexane at low conversion (< 5%) using as a basis a complex free radical chain mechanism and taking into account H abstraction from propene has been adjusted and compared to the observed product distribution. A reasonably good agreement is found between the computed curves and the experimental results obtained at 693 K and 133 mbar.
引用
收藏
页码:29 / 40
页数:12
相关论文
共 15 条
[1]   A COMPILATION OF KINETIC-PARAMETERS FOR THE THERMAL-DEGRADATION OF NORMAL-ALKANE MOLECULES [J].
ALLARA, DL ;
SHAW, R .
JOURNAL OF PHYSICAL AND CHEMICAL REFERENCE DATA, 1980, 9 (03) :523-559
[2]   MECHANISTIC MODELING OF HOMOGENEOUS REACTORS - A CHEMICAL COMPILER [J].
ALRAN, D ;
COME, GM ;
CUNIN, PY ;
GRIFFITHS, M .
COMPUTERS & CHEMICAL ENGINEERING, 1979, 3 (1-4) :87-89
[3]  
Benson, 1976, THERMOCHEMICAL KINET, V23, P613
[4]   MECHANISTIC MODELING OF THE PYROLYSIS OF 3-METHYLPENTANE [J].
BILLAUD, F ;
ELYAHYAOUI, K ;
BARONNET, F ;
MARQUAIRE, PM ;
MULLER, C ;
COME, GM .
THERMOCHIMICA ACTA, 1990, 164 :37-53
[5]   PYROLYSIS OF 2,2-DIMETHYLBUTANE IN THE PRESENCE OF AN ALKENE AT CA 450-DEGREES-C .1. KINETIC-STUDY [J].
BILLAUD, F ;
BARONNET, F ;
NICLAUSE, M .
REACTION KINETICS AND CATALYSIS LETTERS, 1982, 20 (3-4) :363-366
[6]   KINETIC AND CHEMICAL INFLUENCE OF ALKENES ON ALKANE PYROLYSIS - REVIEW AND NEW RESULTS [J].
BILLAUD, F ;
BARONNET, F ;
NICLAUSE, M .
CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1985, 63 (11) :2869-2884
[7]  
BITTKER A, 1972, NASAKINETICS
[8]   COMPUTER-PROGRAMS AND DATA-BASES FOR THE GAS-PHASE REACTIONS [J].
COME, GM ;
SCACCHI, G ;
MULLER, C ;
MARQUAIRE, PM .
JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE, 1988, 85 (02) :201-208
[9]   A LINEAR CHEMICAL NOTATION [J].
COME, GM ;
MULLER, C ;
CUNIN, PY ;
GRIFFITHS, M .
COMPUTERS & CHEMISTRY, 1984, 8 (04) :233-237
[10]   THE THERMAL-DECOMPOSITION OF NORMAL-HEXANE [J].
EBERT, KH ;
EDERER, HJ ;
ISBARN, G .
INTERNATIONAL JOURNAL OF CHEMICAL KINETICS, 1983, 15 (05) :475-502