Chemical Properties of 2,6-Difluorobenzoic acid, 4-chlorophenyl ester

2,6-Difluorobenzoic acid, 4-chlorophenyl ester

InChI
InChI=1S/C13H7ClF2O2/c14-8-4-6-9(7-5-8)18-13(17)12-10(15)2-1-3-11(12)16/h1-7H
InChI Key
AQUGJAIAJWQALG-UHFFFAOYSA-N
Formula
C13H7ClF2O2
SMILES
O=C(Oc1ccc(Cl)cc1)c1c(F)cccc1F
Molecular Weight1
268.64
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Physical Properties

Property Value Unit Source
ΔfusH° 31.07 kJ/mol Joback Calculated Property
IE 8.79 eV Relay (1.0) Calculated Property
log10WS -5.28 Relay (1.0) Calculated Property
logPoct/wat 3.837 Crippen Calculated Property
McVol 169.730 ml/mol McGowan Calculated Property
Inp 1767.00 NIST
Tfus 335.89 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [400.64; 457.65] J/mol×K [659.53; 888.39] Show Hide
Cp,gas 400.64 J/mol×K 659.53 Joback Calculated Property
Cp,gas 412.45 J/mol×K 697.67 Joback Calculated Property
Cp,gas 423.30 J/mol×K 735.82 Joback Calculated Property
Cp,gas 433.22 J/mol×K 773.96 Joback Calculated Property
Cp,gas 442.23 J/mol×K 812.10 Joback Calculated Property
Cp,gas 450.37 J/mol×K 850.25 Joback Calculated Property
Cp,gas 457.65 J/mol×K 888.39 Joback Calculated Property

Similar Compounds

2,6-Difluorobenzoic acid, 3,4-dichlorophenyl ester. 2,6-Difluorobenzoic acid, phenyl ester. 2-Fluorobenzoic acid, 4-chlorophenyl ester. 2,6-Difluorobenzoic acid, 4-methoxyphenyl ester. 2,6-Difluorobenzoic acid, 2-chlorophenyl ester. 2,6-Difluorobenzoic acid, 4-cyanophenyl ester. 2,5-Difluorobenzoic acid, 4-chlorophenyl ester. 2,4-Difluorobenzoic acid, 4-chlorophenyl ester. 2,6-Difluorobenzoic acid, 2-naphthyl ester. 2-Fluorobenzoic acid, 3,4-dichlorophenyl ester. 2,3,4-Trifluorobenzoic acid, 4-chlorophenyl ester. 2,6-Difluorobenzoic acid, 3,5-difluorophenyl ester. 2,6-Difluorobenzoic acid, 4-nitrophenyl ester. 2,5-Difluorobenzoic acid, 3,4-dichlorophenyl ester. 2,4-Difluorobenzoic acid, 3,4-dichlorophenyl ester.

Find more compounds similar to 2,6-Difluorobenzoic acid, 4-chlorophenyl ester.

Sources

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