Chemical Properties of 2-Trifluoromethylbenzoic acid, 4-chlorophenyl ester

2-Trifluoromethylbenzoic acid, 4-chlorophenyl ester

InChI
InChI=1S/C14H8ClF3O2/c15-9-5-7-10(8-6-9)20-13(19)11-3-1-2-4-12(11)14(16,17)18/h1-8H
InChI Key
JKWUCDALVOYHGH-UHFFFAOYSA-N
Formula
C14H8ClF3O2
SMILES
O=C(Oc1ccc(Cl)cc1)c1ccccc1C(F)(F)F
Molecular Weight1
300.66
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Physical Properties

Property Value Unit Source
ΔfusH° 29.71 kJ/mol Joback Calculated Property
IE 8.87 eV Relay (1.0) Calculated Property
log10WS -4.94 Relay (1.0) Calculated Property
logPoct/wat 4.578 Crippen Calculated Property
McVol 185.590 ml/mol McGowan Calculated Property
Inp [1784.00; 1784.00]   Show Hide
Inp 1784.00 NIST
Inp 1784.00 NIST
Tfus 315.51 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 [462.67; 521.45] J/mol×K [673.47; 899.60] Show Hide
Cp,gas 462.67 J/mol×K 673.47 Joback Calculated Property
Cp,gas 475.04 J/mol×K 711.16 Joback Calculated Property
Cp,gas 486.30 J/mol×K 748.85 Joback Calculated Property
Cp,gas 496.50 J/mol×K 786.53 Joback Calculated Property
Cp,gas 505.72 J/mol×K 824.22 Joback Calculated Property
Cp,gas 514.02 J/mol×K 861.91 Joback Calculated Property
Cp,gas 521.45 J/mol×K 899.60 Joback Calculated Property

Similar Compounds

2-Trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-chlorophenyl ester. 2-Trifluoromethylbenzoic acid, phenyl ester. 2-Trifluoromethylbenzoic acid, 2-chlorophenyl ester. 2-Trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 2-Trifluoromethylbenzoic acid, 4-cyanophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 4-chlorophenyl ester. 2-Trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 4-chlorophenyl ester. 2-Trifluoromethylbenzoic acid, 2-naphthyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3,4-dichlorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, phenyl ester. 2-Trifluoromethylbenzoic acid, 3-methylphenyl ester. 2-Trifluoromethylbenzoic acid, 4-biphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester.

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

Sources

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