Chemical Properties of 2,5-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester

2,5-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester

InChI
InChI=1S/C22H18F2O3/c1-14(15-6-4-3-5-7-15)18-13-17(26-2)9-11-21(18)27-22(25)19-12-16(23)8-10-20(19)24/h3-14H,1-2H3
InChI Key
RSZKVNAJCUROJW-UHFFFAOYSA-N
Formula
C22H18F2O3
SMILES
COc1ccc(OC(=O)c2cc(F)ccc2F)c(C(C)c2ccccc2)c1
Molecular Weight1
368.37
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
Δfus 39.91 kJ/mol Joback Calculated Property
logPoct/wat 5.344 Crippen Calculated Property
McVol 266.410 ml/mol McGowan Calculated Property
Inp [2616.00; 2616.00]   Show Hide
Inp 2616.00 NIST
Inp 2616.00 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 [796.11; 855.35] J/mol×K [899.53; 1134.12] Show Hide
Cp,gas 796.11 J/mol×K 899.53 Joback Calculated Property
Cp,gas 809.33 J/mol×K 938.63 Joback Calculated Property
Cp,gas 821.16 J/mol×K 977.73 Joback Calculated Property
Cp,gas 831.63 J/mol×K 1016.83 Joback Calculated Property
Cp,gas 840.79 J/mol×K 1055.92 Joback Calculated Property
Cp,gas 848.69 J/mol×K 1095.02 Joback Calculated Property
Cp,gas 855.35 J/mol×K 1134.12 Joback Calculated Property

Similar Compounds

2,4-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 3,4-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 3-Chloro-2-fluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 2,4,5-Trifluoro-3-methoxybenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 3-Fluoro-6-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. Benzoic acid, 2-(1-phenylethyl)-4-methoxyphenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 3-Chlorobenzoic acid, 2-(1-phenylethyl)-4-methoxyphenyl ester. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. narwedine. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Baptifoline.

Find more compounds similar to 2,5-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl 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.