Chemical Properties of 2-Trifluoromethylbenzoic acid, pentafluorophenyl ester

2-Trifluoromethylbenzoic acid, pentafluorophenyl ester

InChI
InChI=1S/C14H4F8O2/c15-7-8(16)10(18)12(11(19)9(7)17)24-13(23)5-3-1-2-4-6(5)14(20,21)22/h1-4H
InChI Key
JZVVLXIXJOGIGX-UHFFFAOYSA-N
Formula
C14H4F8O2
SMILES
O=C(Oc1c(F)c(F)c(F)c(F)c1F)c1ccccc1C(F)(F)F
Molecular Weight1
356.17
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Physical Properties

Property Value Unit Source
ΔfusH° 39.36 kJ/mol Joback Calculated Property
log10WS -6.50 Relay (1.0) Calculated Property
logPoct/wat 4.620 Crippen Calculated Property
McVol 182.200 ml/mol McGowan Calculated Property
Inp [1516.00; 1516.00]   Show Hide
Inp 1516.00 NIST
Inp 1516.00 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, 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 [474.30; 525.16] J/mol×K [652.31; 836.23] Show Hide
Cp,gas 474.30 J/mol×K 652.31 Joback Calculated Property
Cp,gas 484.43 J/mol×K 682.96 Joback Calculated Property
Cp,gas 493.88 J/mol×K 713.62 Joback Calculated Property
Cp,gas 502.66 J/mol×K 744.27 Joback Calculated Property
Cp,gas 510.78 J/mol×K 774.93 Joback Calculated Property
Cp,gas 518.28 J/mol×K 805.58 Joback Calculated Property
Cp,gas 525.16 J/mol×K 836.23 Joback Calculated Property

Similar Compounds

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

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

Sources

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