Chemical Properties of 2,4,5-Trifluoro-3-methoxybenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester

2,4,5-Trifluoro-3-methoxybenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester

InChI
InChI=1S/C23H19F3O4/c1-13(14-7-5-4-6-8-14)16-11-15(28-2)9-10-19(16)30-23(27)17-12-18(24)21(26)22(29-3)20(17)25/h4-13H,1-3H3
InChI Key
QVGKRNVGTXBFBH-UHFFFAOYSA-N
Formula
C23H19F3O4
SMILES
COc1ccc(OC(=O)c2cc(F)c(F)c(OC)c2F)c(C(C)c2ccccc2)c1
Molecular Weight1
416.39
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Physical Properties

Property Value Unit Source
ΔfusH° 47.58 kJ/mol Joback Calculated Property
logPoct/wat 5.492 Crippen Calculated Property
McVol 288.140 ml/mol McGowan Calculated Property
Inp [2759.00; 2759.00]   Show Hide
Inp 2759.00 NIST
Inp 2759.00 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 [879.93; 927.78] J/mol×K [936.19; 1162.24] Show Hide
Cp,gas 879.93 J/mol×K 936.19 Joback Calculated Property
Cp,gas 891.70 J/mol×K 973.86 Joback Calculated Property
Cp,gas 901.93 J/mol×K 1011.54 Joback Calculated Property
Cp,gas 910.64 J/mol×K 1049.21 Joback Calculated Property
Cp,gas 917.85 J/mol×K 1086.89 Joback Calculated Property
Cp,gas 923.56 J/mol×K 1124.56 Joback Calculated Property
Cp,gas 927.78 J/mol×K 1162.24 Joback Calculated Property

Similar Compounds

2,5-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 2,4-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 3,4-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. Baptifoline. Epibaptifoline. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Argentamin. Dehydrojaconine. AJMALINE, M(HO-), AC. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Normorphine TMS. Neopine. Hydromorphone, trimethylsilyl ether. Ergocristine.

Find more compounds similar to 2,4,5-Trifluoro-3-methoxybenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester.

Sources

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