Chemical Properties of 2-Trifluoromethylbenzoic acid, 3,5-difluorophenyl ester

2-Trifluoromethylbenzoic acid, 3,5-difluorophenyl ester

InChI
InChI=1S/C14H7F5O2/c15-8-5-9(16)7-10(6-8)21-13(20)11-3-1-2-4-12(11)14(17,18)19/h1-7H
InChI Key
KZBUKYOPXCWIMY-UHFFFAOYSA-N
Formula
C14H7F5O2
SMILES
O=C(Oc1cc(F)cc(F)c1)c1ccccc1C(F)(F)F
Molecular Weight1
302.20
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Physical Properties

Property Value Unit Source
ΔfusH° 31.29 kJ/mol Joback Calculated Property
log10WS -5.26 Relay (1.0) Calculated Property
logPoct/wat 4.203 Crippen Calculated Property
McVol 176.890 ml/mol McGowan Calculated Property
Inp [1607.00; 1607.00]   Show Hide
Inp 1607.00 NIST
Inp 1607.00 NIST
Tfus 308.16 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, Ionization energy 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 [453.23; 513.05] J/mol×K [639.56; 844.18] Show Hide
Cp,gas 453.23 J/mol×K 639.56 Joback Calculated Property
Cp,gas 465.42 J/mol×K 673.66 Joback Calculated Property
Cp,gas 476.67 J/mol×K 707.77 Joback Calculated Property
Cp,gas 487.01 J/mol×K 741.87 Joback Calculated Property
Cp,gas 496.50 J/mol×K 775.97 Joback Calculated Property
Cp,gas 505.16 J/mol×K 810.08 Joback Calculated Property
Cp,gas 513.05 J/mol×K 844.18 Joback Calculated Property

Similar Compounds

2,5-Di(trifluoromethyl)benzoic acid, 3,5-difluophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,5-difluophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 3,5-difluophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3-fluorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-fluorophenyl ester. 2-Trifluoromethylbenzoic acid, phenyl ester. 3-Trifluoromethylbenzoic acid, 3,5-difluorophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 3,5-difluophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, phenyl ester. 2-Trifluoromethylbenzoic acid, pentafluorophenyl ester. 2-Trifluoromethylbenzoic acid, 4-chlorophenyl ester. 2-Trifluoromethylbenzoic acid, 2-naphthyl ester. 2-Trifluoromethylbenzoic acid, 4-cyanophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, phenyl ester. 2-Trifluoromethylbenzoic acid, 4-methoxyphenyl ester.

Find more compounds similar to 2-Trifluoromethylbenzoic acid, 3,5-difluorophenyl ester.

Sources

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