Chemical Properties of 2,4-Difluorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester

2,4-Difluorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester

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InChI
InChI=1S/C13H4Cl4F2O2/c14-7-4-8(15)12(11(17)10(7)16)21-13(20)6-2-1-5(18)3-9(6)19/h1-4H
InChI Key
JEJOXPHAGVGUNT-UHFFFAOYSA-N
Formula
C13H4Cl4F2O2
SMILES
O=C(Oc1c(Cl)cc(Cl)c(Cl)c1Cl)c1ccc(F)cc1F
Molecular Weight1
371.98
Sources

Physical Properties

Property Value Unit Source
Δf -445.64 kJ/mol Joback Calculated Property
Δfgas -607.39 kJ/mol Joback Calculated Property
Δfus 40.91 kJ/mol Joback Calculated Property
Δvap 78.12 kJ/mol Joback Calculated Property
logPoct/wat 5.80 Crippen Calculated Property
Pc 2298.11 kPa Joback Calculated Property
Tboil 804.63 K Joback Calculated Property
Tc 1044.95 K Joback Calculated Property
Tfus 557.25 K Joback Calculated Property
Vc 0.80 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 458.01 J/mol×K 804.63 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2,4-Difluorobenzoic acid, 2,4,5-trichlorophenyl ester. Pentafluorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester. Pentafluorobenzoic acid, 2,4,5-trichlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 2,4,5-trichlorophenyl ester. Benzoic acid, 2,3,4,6-tetrachlorophenyl ester. 4-Chlorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 4-Methylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 2-Fluorobenzoic acid, 3,4-dichlorophenyl ester. 2,3,4-Trifluorobenzoic acid, 3,4-dichlorophenyl ester. 3-Fluorobenzoic acid, 2,4,5-trichlorophenyl ester. 2,6-Difluorobenzoic acid, 2-chlorophenyl ester. 3-Methoxy-2,4,5-trifluorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester. Benzoic acid, 3-methyl-, 2,3,4,6-tetrachlorophenyl ester. 4-Butylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester.

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