Chemical Properties of 4-Fluoro-2-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester

4-Fluoro-2-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester

InChI
InChI=1S/C21H14F4O3/c22-15-6-11-18(19(12-15)21(23,24)25)20(26)28-17-9-7-16(8-10-17)27-13-14-4-2-1-3-5-14/h1-12H,13H2
InChI Key
RYZRLHOQQWIVFZ-UHFFFAOYSA-N
Formula
C21H14F4O3
SMILES
O=C(Oc1ccc(OCc2ccccc2)cc1)c1ccc(F)cc1C(F)(F)F
Molecular Weight1
390.33
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Physical Properties

Property Value Unit Source
ΔfusH° 39.98 kJ/mol Joback Calculated Property
IE 8.36 eV Relay (1.0) Calculated Property
logPoct/wat 5.643 Crippen Calculated Property
McVol 255.860 ml/mol McGowan Calculated Property
Inp [2581.00; 2581.00]   Show Hide
Inp 2581.00 NIST
Inp 2581.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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 [755.82; 813.07] J/mol×K [867.42; 1094.88] Show Hide
Cp,gas 755.82 J/mol×K 867.42 Joback Calculated Property
Cp,gas 768.15 J/mol×K 905.33 Joback Calculated Property
Cp,gas 779.27 J/mol×K 943.24 Joback Calculated Property
Cp,gas 789.25 J/mol×K 981.15 Joback Calculated Property
Cp,gas 798.16 J/mol×K 1019.06 Joback Calculated Property
Cp,gas 806.08 J/mol×K 1056.97 Joback Calculated Property
Cp,gas 813.07 J/mol×K 1094.88 Joback Calculated Property

Similar Compounds

5-Fluoro-2-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 2-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3-methylphenyl ester. 2,5-Ditrifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dimethylphenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 3-methylphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 4-cyanophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, phenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3-fluorophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 4-chlorophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester.

Find more compounds similar to 4-Fluoro-2-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester.

Sources

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