Chemical Properties of 2,5-Di(trifluoromethyl)benzoic acid, 4-isopropylphenyl ester

2,5-Di(trifluoromethyl)benzoic acid, 4-isopropylphenyl ester

InChI
InChI=1S/C18H14F6O2/c1-10(2)11-3-6-13(7-4-11)26-16(25)14-9-12(17(19,20)21)5-8-15(14)18(22,23)24/h3-10H,1-2H3
InChI Key
VBTOTMSSWKIZKW-UHFFFAOYSA-N
Formula
C18H14F6O2
SMILES
CC(C)c1ccc(OC(=O)c2cc(C(F)(F)F)ccc2C(F)(F)F)cc1
Molecular Weight1
376.29
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Physical Properties

Property Value Unit Source
ΔfusH° 33.79 kJ/mol Joback Calculated Property
logPoct/wat 6.067 Crippen Calculated Property
McVol 235.020 ml/mol McGowan Calculated Property
Inp 1814.00 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, 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 [671.09; 738.59] J/mol×K [726.68; 926.79] Show Hide
Cp,gas 671.09 J/mol×K 726.68 Joback Calculated Property
Cp,gas 684.82 J/mol×K 760.03 Joback Calculated Property
Cp,gas 697.47 J/mol×K 793.38 Joback Calculated Property
Cp,gas 709.10 J/mol×K 826.74 Joback Calculated Property
Cp,gas 719.79 J/mol×K 860.09 Joback Calculated Property
Cp,gas 729.59 J/mol×K 893.44 Joback Calculated Property
Cp,gas 738.59 J/mol×K 926.79 Joback Calculated Property

Similar Compounds

4-Fluoro-2-trifluoromethylbenzoic acid, 4-isopropylphenyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, 4-isopropylphenyl ester. 6-Fluoro-3-trifluoromethylbenzoic acid, 4-isopropylphenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 4-isopropylphenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3,4-dimethylphenyl ester. 2-Trifluoromethylbenzoic acid, 2-propylphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 4-isopropylphenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-cyanophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-fluorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, phenyl ester. 2,5-Ditrifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. Isophthalic acid, ethyl 4-isopropylphenyl ester. Isophthalic acid, 4-isopropylphenyl propyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-methylphenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 2-biphenyl ester.

Find more compounds similar to 2,5-Di(trifluoromethyl)benzoic acid, 4-isopropylphenyl ester.

Sources

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