Chemical Properties of 3,4-Dichlorobenzoic acid, 3,4-dimethylphenyl ester (CAS 107922-19-0)

3,4-Dichlorobenzoic acid, 3,4-dimethylphenyl ester

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InChI
InChI=1S/C15H12Cl2O2/c1-9-3-5-12(7-10(9)2)19-15(18)11-4-6-13(16)14(17)8-11/h3-8H,1-2H3
InChI Key
SBCGPYZFIQDMKP-UHFFFAOYSA-N
Formula
C15H12Cl2O2
SMILES
Cc1ccc(OC(=O)c2ccc(Cl)c(Cl)c2)cc1C
Molecular Weight1
295.16
CAS
107922-19-0
Sources

Physical Properties

Property Value Unit Source
Δf 3.94 kJ/mol Joback Calculated Property
Δfgas -202.03 kJ/mol Joback Calculated Property
Δfus 32.31 kJ/mol Joback Calculated Property
Δvap 74.11 kJ/mol Joback Calculated Property
logPoct/wat 4.83 Crippen Calculated Property
Pc 2302.53 kPa Joback Calculated Property
Tboil 767.03 K Joback Calculated Property
Tc 1012.56 K Joback Calculated Property
Tfus 493.73 K Joback Calculated Property
Vc 0.78 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 510.29 J/mol×K 767.03 Joback Calculated Property
η 0.00 Pa×s 767.03 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 2
>C=O (nonring) 1
=CH- (ring) 6
=C< (ring) 6
-CH3 2

Similar Compounds

3-Chlorobenzoic acid, 3,4-dimethylphenyl ester. 3-Chlorobenzoic acid, 3-methylphenyl ester. 3,4-Dichlorobenzoic acid, 4-isopropyl phenyl ester. 4-Chlorobenzoic acid, 3,5-dimethylphenyl ester. 3-Chlorobenzoic acid, 4-cyanophenyl ester. 3-Chlorobenzoic acid, 4-isopropylphenyl ester. 3-Chlorobenzoic acid, phenyl ester. Isophthalic acid, di(3,4-dimethylphenyl) ester. 3-Chlorobenzoic acid, 4-benzyloxyphenyl ester. 3-Chlorobenzoic acid, 4-methoxyphenyl ester. 3-Chlorobenzoic acid, 4-chlorophenyl ester. 3-Chlorobenzoic acid, 3,4-dichlorophenyl ester. P-anisic acid, 3,5-dimethylphenyl ester. p-Anisic acid, 3-methylphenyl ester. 2-Chlorobenzoic acid, 3,5-dimethylphenyl ester.

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