scholarly journals The gas-phase reaction of hydrogen bromide with vinyl chloride

1970 ◽  
Vol 23 (11) ◽  
pp. 2379
Author(s):  
KD King ◽  
ES Swinbourne

1969 ◽  
Vol 22 (4) ◽  
pp. 713 ◽  
Author(s):  
NJ Daly ◽  
MF Gilligan

In the gas phase, acetic acid reacts with hydrogen bromide in the temperature range 412-492� to give methyl bromide, carbon monoxide, and water. The reaction is first order in each reagent, and the variation of rate constant with temperature is described by the equation �� ����������������� k2 = 1011.67exp(-30400/RT) ml mole-1 sec-1 Possible transition states for the reaction are examined. A mechanism involving an intermediate of the type CH3CO+Br- is possible if the reaction is of the family represented by the hydrogen bromide catalysed decompositions of trimethylacetic, isobutyric, and propionic acids.







1971 ◽  
Vol 24 (9) ◽  
pp. 1823
Author(s):  
NJ Daly ◽  
MF Gilligan

In the gas phase methyl acetate reacts with hydrogen bromide over the range 419-497� to give methyl bromide, carbon monoxide, and methanol. Rate constants first order in both ester and hydrogen bromide are calculated from initial slopes, and are described by the equation �������������������� k2 = 1012.29exp(-32312/RT) ml mol-1 s-1 Kinetic data depart from this second-order form at early stages of the reaction. The addition of methanol can reduce the value of k2 to zero. A mechanism involving the reversible step : ������������������������ CH3COOCH3+HBr ↔ CH3OH+A* is proposed. The intermediate reacts with isobutene to form mesityl oxide, and is considered identical with that formed in the reaction of acetic acid with hydrogen bromide.



2019 ◽  
Author(s):  
Javad Noroozi ◽  
William Smith

We use molecular dynamics free energy simulations in conjunction with quantum chemical calculations of gas phase reaction free energy to predict alkanolamines pka values. <br>



2021 ◽  
Vol 330 ◽  
pp. 125002
Author(s):  
Yan-Yu Chen ◽  
Yuki Soma ◽  
Masahito Ishikawa ◽  
Masatomo Takahashi ◽  
Yoshihiro Izumi ◽  
...  


Sign in / Sign up

Export Citation Format

Share Document