Chemical Properties of Benzoic acid, 3,4-dichlorophenyl ester

Benzoic acid, 3,4-dichlorophenyl ester

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InChI
InChI=1S/C13H8Cl2O2/c14-11-7-6-10(8-12(11)15)17-13(16)9-4-2-1-3-5-9/h1-8H
InChI Key
RPLHUYYGJWQIFA-UHFFFAOYSA-N
Formula
C13H8Cl2O2
SMILES
O=C(Oc1ccc(Cl)c(Cl)c1)c1ccccc1
Molecular Weight1
267.11
Sources

Physical Properties

Property Value Unit Source
Δf 6.36 kJ/mol Joback Calculated Property
Δfgas -137.81 kJ/mol Joback Calculated Property
Δfus 27.91 kJ/mol Joback Calculated Property
Δvap 68.33 kJ/mol Joback Calculated Property
logPoct/wat 4.213 Crippen Calculated Property
Pc 2884.30 kPa Joback Calculated Property
Tboil 711.31 K Joback Calculated Property
Tc 966.18 K Joback Calculated Property
Tfus 446.15 K Joback Calculated Property
Vc 0.669 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 410.63 J/mol×K 711.31 Joback Calculated Property
η 0.0001443 Pa×s 711.31 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< (ring) 4
>C=O (nonring) 1
-Cl 2
=CH- (ring) 8

Similar Compounds

P-toluic acid, 3,4-dichlorophenyl ester. P-anisic acid, 3,4-dichlorophenyl ester. 4-Fluorobenzoic acid, 3,4-dichlorophenyl ester. 3-Chlorobenzoic acid, 3,4-dichlorophenyl ester. 4-Ethylbenzoic acid, 3,4-dichlorophenyl ester. 4-Trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. O-toluic acid, 3,4-dichlorophenyl ester. 2-Chlorobenzoic acid, 3,4-dichlorophenyl ester. 3-Bromobenzoic acid, 3,4-dichlorophenyl ester. Benzoic acid, 2,4,5-trichlorophenyl ester. 1-Naphthoic acid, 3,4-dichlorophenyl ester. 2-Bromobenzoic acid, 3,4-dichlorophenyl ester. 4-Chlorobenzoic acid, 2,4,5-trichlorophenyl ester. 2-Fluorobenzoic acid, 3,4-dichlorophenyl ester. 4-Nitrobenzoic acid, 3,4-dichlorophenyl ester.

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