Chemical Properties of 3-Fluorobenzoic acid, 4-benzyloxyphenyl ester

3-Fluorobenzoic acid, 4-benzyloxyphenyl ester

InChI
InChI=1S/C20H15FO3/c21-17-8-4-7-16(13-17)20(22)24-19-11-9-18(10-12-19)23-14-15-5-2-1-3-6-15/h1-13H,14H2
InChI Key
VITWHNCNPZBBSV-UHFFFAOYSA-N
Formula
C20H15FO3
SMILES
O=C(Oc1ccc(OCc2ccccc2)cc1)c1cccc(F)c1
Molecular Weight1
322.33
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Physical Properties

Property Value Unit Source
ΔfH°gas -381.71 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 37.54 kJ/mol Joback Calculated Property
IE 8.25 eV Relay (1.0) Calculated Property
log10WS -5.68 Relay (1.0) Calculated Property
logPoct/wat 4.624 Crippen Calculated Property
McVol 236.460 ml/mol McGowan Calculated Property
Inp [2586.00; 2586.00]   Show Hide
Inp 2586.00 NIST
Inp 2586.00 NIST
Tboil 677.88 K Relay (1.0) Calculated Property
Tfus 342.00 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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 [673.59; 736.33] J/mol×K [827.11; 1070.12] Show Hide
Cp,gas 673.59 J/mol×K 827.11 Joback Calculated Property
Cp,gas 687.55 J/mol×K 867.61 Joback Calculated Property
Cp,gas 700.03 J/mol×K 908.11 Joback Calculated Property
Cp,gas 711.09 J/mol×K 948.61 Joback Calculated Property
Cp,gas 720.79 J/mol×K 989.11 Joback Calculated Property
Cp,gas 729.18 J/mol×K 1029.62 Joback Calculated Property
Cp,gas 736.33 J/mol×K 1070.12 Joback Calculated Property

Similar Compounds

3,4-Difluorobenzoic acid, 4-benzyloxyphenyl ester. 2,5-Difluorobenzoic acid, 4-benzyloxyphenyl ester. 4-Fluorobenzoic acid, 4-benzyloxyphenyl ester. 2-Fluorobenzoic acid, 4-benzyloxyphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 2,3,4-Trifluorobenzoic acid, 4-benzyloxyphenyl ester. 2,4-Difluorobenzoic acid, 4-benzyloxyphenyl ester. 2,6-Difluorobenzoic acid, 4-benzyloxyphenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 3-Fluorobenzoic acid, 4-methoxyphenyl ester. 3-Fluorobenzoic acid, 3-methylphenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. p-Toluic acid, 4-benzyloxyphenyl ester. 3,4-Difluorobenzoic acid, 3-methylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-benzyloxyphenyl ester.

Find more compounds similar to 3-Fluorobenzoic acid, 4-benzyloxyphenyl ester.

Sources

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