Chemical Properties of 4-Cyanobenzoic acid, 2-chlorophenyl ester

4-Cyanobenzoic acid, 2-chlorophenyl ester

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InChI
InChI=1S/C14H8ClNO2/c15-12-3-1-2-4-13(12)18-14(17)11-7-5-10(9-16)6-8-11/h1-8H
InChI Key
WNVUMPBLXYWKLI-UHFFFAOYSA-N
Formula
C14H8ClNO2
SMILES
N#Cc1ccc(C(=O)Oc2ccccc2Cl)cc1
Molecular Weight1
257.67
Sources

Physical Properties

Property Value Unit Source
Δf 159.89 kJ/mol Joback Calculated Property
Δfgas 22.17 kJ/mol Joback Calculated Property
Δfus 27.81 kJ/mol Joback Calculated Property
Δvap 76.65 kJ/mol Joback Calculated Property
logPoct/wat 3.43 Crippen Calculated Property
Pc 2640.67 kPa Joback Calculated Property
Tboil 798.84 K Joback Calculated Property
Tc 1055.44 K Joback Calculated Property
Tfus 492.49 K Joback Calculated Property
Vc 0.70 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 451.68 J/mol×K 798.84 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CN 1
-Cl 1
=CH- (ring) 8
=C< (ring) 4
>C=O (nonring) 1

Similar Compounds

P-toluic acid, 2-chlorophenyl ester. P-methoxybenzoic acid, 2-chlorophenyl ester. 4-Fluorobenzoic acid, 2-chlorophenyl ester. Benzoic acid, 4-cyano-, phenyl ester. 3-Bromobenzoic acid, 2-chlorophenyl ester. 3-Fluorobenzoic acid, 2-chlorophenyl ester. 2-Bromobenzoic acid, 2-chlorophenyl ester. 2-Fluorobenzoic acid, 2-chlorophenyl ester. 4-Nitrobenzoic acid, 2-chlorophenyl ester. 3-Chlorobenzoic acid, 2,3-dichlorophenyl ester. Isophthalic acid, di(2-chloro-5-methylphenyl) ester. P-toluic acid, 4-cyanophenyl ester. 3-Trifluoromethylbenzoic acid, 2-chlorophenyl ester. Benzoic acid, 4-methyl-, phenyl ester. Benzoic acid, 2,4,5-trichlorophenyl ester.

Find more compounds similar to 4-Cyanobenzoic acid, 2-chlorophenyl ester.

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