Chemical Properties of 3-Chloro-2-fluorobenzoic acid, 4-chlorophenyl ester

3-Chloro-2-fluorobenzoic acid, 4-chlorophenyl ester

InChI
InChI=1S/C13H7Cl2FO2/c14-8-4-6-9(7-5-8)18-13(17)10-2-1-3-11(15)12(10)16/h1-7H
InChI Key
DYUOKCUAXQWYFV-UHFFFAOYSA-N
Formula
C13H7Cl2FO2
SMILES
O=C(Oc1ccc(Cl)cc1)c1cccc(Cl)c1F
Molecular Weight1
285.10
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Physical Properties

Property Value Unit Source
ΔfusH° 30.60 kJ/mol Joback Calculated Property
IE 8.71 eV Relay (1.0) Calculated Property
log10WS -5.55 Relay (1.0) Calculated Property
logPoct/wat 4.352 Crippen Calculated Property
McVol 180.200 ml/mol McGowan Calculated Property
Inp 2092.00 NIST
Tboil 602.00 K Relay (1.0) Calculated Property
Tfus 336.75 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [416.98; 469.29] J/mol×K [715.56; 959.61] Show Hide
Cp,gas 416.98 J/mol×K 715.56 Joback Calculated Property
Cp,gas 428.00 J/mol×K 756.24 Joback Calculated Property
Cp,gas 438.06 J/mol×K 796.91 Joback Calculated Property
Cp,gas 447.19 J/mol×K 837.59 Joback Calculated Property
Cp,gas 455.42 J/mol×K 878.26 Joback Calculated Property
Cp,gas 462.77 J/mol×K 918.94 Joback Calculated Property
Cp,gas 469.29 J/mol×K 959.61 Joback Calculated Property

Similar Compounds

3-Chloro-2-fluorobenzoic acid, phenylester. 3-Chloro-2-fluorobenzoic acid, 3,4-dichlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-methoxyphenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-cyanophenyl ester. 3-Chloro-2-fluorobenzoic acid, 3-fluorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 3,5-difluophenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-nitrophenyl ester. 2-Fluorobenzoic acid, 4-chlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 2,4,5-trichlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 3-methylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-biphenyl ester. 3-Chloro-2-fluorobenzoic acid, 2,3-dichlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-benzyloxyphenyl ester. 2-Fluorobenzoic acid, 3,4-dichlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 3,4-dimethylphenyl ester.

Find more compounds similar to 3-Chloro-2-fluorobenzoic acid, 4-chlorophenyl ester.

Sources

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