Chemical Properties of 2,3,4-Trifluorobenzoic acid, 3,5-dimethylphenyl ester

2,3,4-Trifluorobenzoic acid, 3,5-dimethylphenyl ester

InChI
InChI=1S/C15H11F3O2/c1-8-5-9(2)7-10(6-8)20-15(19)11-3-4-12(16)14(18)13(11)17/h3-7H,1-2H3
InChI Key
JFBJHQAKRZWJKB-UHFFFAOYSA-N
Formula
C15H11F3O2
SMILES
Cc1cc(C)cc(OC(=O)c2ccc(F)c(F)c2F)c1
Molecular Weight1
280.24
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 34.35 kJ/mol Joback Calculated Property
log10WS -5.78 Relay (1.0) Calculated Property
logPoct/wat 3.940 Crippen Calculated Property
McVol 187.440 ml/mol McGowan Calculated Property
Inp [1785.00; 1785.00]   Show Hide
Inp 1785.00 NIST
Inp 1785.00 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 [481.96; 547.43] J/mol×K [677.09; 887.32] Show Hide
Cp,gas 481.96 J/mol×K 677.09 Joback Calculated Property
Cp,gas 495.03 J/mol×K 712.13 Joback Calculated Property
Cp,gas 507.22 J/mol×K 747.17 Joback Calculated Property
Cp,gas 518.54 J/mol×K 782.20 Joback Calculated Property
Cp,gas 529.01 J/mol×K 817.24 Joback Calculated Property
Cp,gas 538.63 J/mol×K 852.28 Joback Calculated Property
Cp,gas 547.43 J/mol×K 887.32 Joback Calculated Property

Similar Compounds

2,4-Difluorobenzoic acid, 3,5-dimethylphenyl ester. 2,3,4-Trifluorobenzoic acid, 3-methylphenyl ester. 3,4-Difluorobenzoic acid, 3,5-dimethylphenyl ester. 2,5-Difluorobenzoic acid, 3,5-dimethylphenyl ester. 2-Fluorobenzoic acid, 3,5-dimethylphenyl ester. 2,4-Difluorobenzoic acid, 3-methylphenyl ester. 2,6-Difluorobenzoic acid, 3,5-dimethylphenyl ester. 3-Fluorobenzoic acid, 3,5-dimethylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3,5-dimethylphenyl ester. 2,4,5-Trifluoro-3-methoxybenzoic acid, 3,5-dimethylphenyl ester. 4-Fluorobenzoic acid, 3,5-dimethylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 3,5-dimethylphenyl ester. 3,4-Difluorobenzoic acid, 3-methylphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester. 2,5-Difluorobenzoic acid, 3-methylphenyl ester.

Find more compounds similar to 2,3,4-Trifluorobenzoic acid, 3,5-dimethylphenyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.