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Representation of Ethyl propionate
Formula : C2H5C(O)OCH2CH3
Name : Ethyl propionate
CAS : 105-37-3
Smiles : O=C(OCC)CC
InChI=1S/C5H10O2/c1-3-5(6)7-4-2/h3-4H2,1-2H3
Function(s) : Esters
Family(ies) : Saturated Oxygenates
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Constant 1 :
kOH: 2.14 ± 0.30 × 10-12 cm3 molecule-1 s-1
T = 296 K
Pressure : 25-50 Torr
Bath Gas : Argon
Technique(s) : flash photolysis - resonance fluorescence
Source : Photolysis of H2O
R e f e r e n c e :
Wallington T. J. , Dagaut P. , Liu R.
The gas phase reactions of hydroxyl radicals with a series of esters over the temperature range 240-440
International Journal of Chemical Kinetics
1988, Vol. 20, pp 177-186
DOI : 10.1002/kin.550200210

Constant 2 :
kOH: 1.76 ± 0.25 × 10-12 cm3 molecule-1 s-1
T = 292 K
Pressure : 100 Torr
Technique(s) : relative rate - gas chromatography
Source : H2O2 + NO2 + CO (+ wall)
Comment : Placed on an absolute basis using k(OH + n-Butane) = 2.6 × 10-12 cm3 molecule-1 s-1;
k derived from the measured CO2 yield in the H2O2/NO2/CO chain reaction in the presence of the ester.

R e f e r e n c e :
Campbell I. M., Parkinson P. E.
Rate constants for reactions of hydroxyl radicals with ester vapours at 292K
Chemical Physics Letters
1978, Vol. 52, pp 385-387
DOI : 10.1016/0009-2614(78)85422-0

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