Chemical Properties of 3-Trifluoromethylbenzoic acid, 2-propylphenyl ester

3-Trifluoromethylbenzoic acid, 2-propylphenyl ester

InChI
InChI=1S/C17H15F3O2/c1-2-6-12-7-3-4-10-15(12)22-16(21)13-8-5-9-14(11-13)17(18,19)20/h3-5,7-11H,2,6H2,1H3
InChI Key
XFRZCFLQFNLQLX-UHFFFAOYSA-N
Formula
C17H15F3O2
SMILES
CCCc1ccccc1OC(=O)c1cccc(C(F)(F)F)c1
Molecular Weight1
308.30
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Physical Properties

Property Value Unit Source
ΔfusH° 33.28 kJ/mol Joback Calculated Property
logPoct/wat 4.877 Crippen Calculated Property
McVol 215.620 ml/mol McGowan Calculated Property
Inp 1832.00 NIST
Tboil 604.53 K Relay (1.0) Calculated Property
Tfus 319.95 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [591.87; 664.60] J/mol×K [704.68; 916.91] Show Hide
Cp,gas 591.87 J/mol×K 704.68 Joback Calculated Property
Cp,gas 606.66 J/mol×K 740.05 Joback Calculated Property
Cp,gas 620.31 J/mol×K 775.42 Joback Calculated Property
Cp,gas 632.86 J/mol×K 810.79 Joback Calculated Property
Cp,gas 644.39 J/mol×K 846.17 Joback Calculated Property
Cp,gas 654.95 J/mol×K 881.54 Joback Calculated Property
Cp,gas 664.60 J/mol×K 916.91 Joback Calculated Property

Similar Compounds

Isophthalic acid, di(2-propylphenyl) ester. Benzoic acid, 3-methyl-, 2-propylphenyl ester. 2-Trifluoromethylbenzoic acid, 2-propylphenyl ester. Benzoic acid, 2-propylphenyl ester. 4-Methylbenzoic acid, 2-propylphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2-propylphenyl ester. Phthalic acid, di(2-propylphenyl) ester. Isophthalic acid, ethyl 2-propylphenyl ester. 4-Butylbenzoic acid, 2-propylphenyl ester. Isophthalic acid, propyl 2-propylphenyl ester. 1-Naphthoic acid, 2-propylphenyl ester. 4-Chlorobenzoic acid, 2-propylphenyl ester. Isophthalic acid, isobutyl 2-propylphenyl ester. 2-Bromobenzoic acid, 2-propylphenyl ester. 3-Bromobenzoic acid, 2-propylphenyl ester.

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

Sources

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