Chemical Properties of Propanoic acid, 3-chloro, 2-propynyl ester

Propanoic acid, 3-chloro, 2-propynyl ester

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InChI
InChI=1S/C6H7ClO2/c1-2-5-9-6(8)3-4-7/h1H,3-5H2
InChI Key
YDELXAFUTFIRRH-UHFFFAOYSA-N
Formula
C6H7ClO2
SMILES
C#CCOC(=O)CCCl
Molecular Weight1
146.57
Sources

Physical Properties

Property Value Unit Source
Δf -23.14 kJ/mol Joback Calculated Property
Δfgas -135.81 kJ/mol Joback Calculated Property
Δfus 21.25 kJ/mol Joback Calculated Property
Δvap 42.35 kJ/mol Joback Calculated Property
logPoct/wat 0.79 Crippen Calculated Property
Pc 3731.66 kPa Joback Calculated Property
Tboil 440.52 K Joback Calculated Property
Tc 638.24 K Joback Calculated Property
Tfus 306.43 K Joback Calculated Property
Vc 0.41 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 196.50 J/mol×K 440.52 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 1
#C- 1
-CH2- 3
#CH 1
>C=O (nonring) 1

Similar Compounds

2-Propyn-1-ol, propionate. Ethyl 3-chloropropionate. Butanoic acid, 3-chloro, 2-propynyl ester. Propanoic acid, 3-chloro-, propyl ester. Butanoic acid, 2-propynyl ester. Propanoic acid, 3-chloro-, 1-methylethyl ester. 3-Chloropropionic acid, tridec-2-ynyl ester. Butanoic acid, 4-chloro, 2-propynyl ester. n-Butyl-3-chloropropionate. Propanoic acid, 3-chloro, 2-propenyl ester. Isobutyl 3-chloropropionate. Propanoic acid, 3-chloro-, methyl ester. 1-Propanol, 3-chloro, propanoate. Propanoic acid, 2-chloro, 2-propynyl ester. Propanoic acid, 3-chloro, 1,1-dimethylethyl ester.

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