Chemical Properties of Propanoic acid, 3-chloro, 1,1-dimethylethyl ester

Propanoic acid, 3-chloro, 1,1-dimethylethyl ester

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InChI
InChI=1S/C7H13ClO2/c1-7(2,3)10-6(9)4-5-8/h4-5H2,1-3H3
InChI Key
PGULCJLBEJUCRO-UHFFFAOYSA-N
Formula
C7H13ClO2
SMILES
CC(C)(C)OC(=O)CCCl
Molecular Weight1
164.63
Sources

Physical Properties

Property Value Unit Source
Δf -234.95 kJ/mol Joback Calculated Property
Δfgas -457.10 kJ/mol Joback Calculated Property
Δfus 13.46 kJ/mol Joback Calculated Property
Δvap 43.42 kJ/mol Joback Calculated Property
logPoct/wat 1.96 Crippen Calculated Property
Pc 2884.30 kPa Joback Calculated Property
Tboil 470.05 K Joback Calculated Property
Tc 664.25 K Joback Calculated Property
Tfus 273.15 K Joback Calculated Property
Vc 0.49 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 268.23 J/mol×K 470.05 Joback Calculated Property
η 0.00 Pa×s 470.05 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 1
>C=O (nonring) 1
-CH2- 2
>C< 1
-CH3 3

Similar Compounds

Propanoic acid, 3-chloro-, 1-methylethyl ester. Propanoic acid, 1,1-dimethylethyl ester. Butanoic acid, 3-chloro, 1,1-dimethylethyl ester. Propanoic acid, 3-chloro, 1,1-dimethylpropyl ester. Isobutyric acid, tert-butyl ester. Butanoic acid, 1,1-dimethylethyl ester. 3-Chloropropanoic acid, 2-butyl ester. Ethyl 3-chloropropionate. Butanoic acid, 4-chloro, 1,1-dimethylethyl ester. Butanoic acid, 3-chloro, 1-methylethyl ester. Isopropyl propionate. Propanoic acid, 2,2-dimethyl, 1,1-dimethylethyl ester. Butanoic acid, 3-chloro, 1,1-dimethylpropyl ester. Pentanoic acid, 1,1-dimethylethyl ester. Propanoic acid, 2-chloro-, 1,1-dimethylethyl ester.

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