Chemical Properties of 2,6-Difluoro-3-methylbenzoic acid, 4-methoxyphenyl ester

2,6-Difluoro-3-methylbenzoic acid, 4-methoxyphenyl ester

InChI
InChI=1S/C15H12F2O3/c1-9-3-8-12(16)13(14(9)17)15(18)20-11-6-4-10(19-2)5-7-11/h3-8H,1-2H3
InChI Key
UNVDFUZGQSCMBI-UHFFFAOYSA-N
Formula
C15H12F2O3
SMILES
COc1ccc(OC(=O)c2c(F)ccc(C)c2F)cc1
Molecular Weight1
278.25
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Physical Properties

Property Value Unit Source
ΔfusH° 32.85 kJ/mol Joback Calculated Property
IE 8.01 eV Relay (1.0) Calculated Property
logPoct/wat 3.501 Crippen Calculated Property
McVol 191.540 ml/mol McGowan Calculated Property
Inp 2064.00 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, 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 [500.43; 567.23] J/mol×K [695.26; 911.35] Show Hide
Cp,gas 500.43 J/mol×K 695.26 Joback Calculated Property
Cp,gas 513.97 J/mol×K 731.28 Joback Calculated Property
Cp,gas 526.55 J/mol×K 767.29 Joback Calculated Property
Cp,gas 538.15 J/mol×K 803.31 Joback Calculated Property
Cp,gas 548.80 J/mol×K 839.32 Joback Calculated Property
Cp,gas 558.49 J/mol×K 875.34 Joback Calculated Property
Cp,gas 567.23 J/mol×K 911.35 Joback Calculated Property

Similar Compounds

2,6-Difluoro-3-methylbenzoic acid, phenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3-fluorophenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 4-benzyloxyphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 4-chlorophenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3-methylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3,4-dichlorophenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3,5-difluophenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3,4-dimethylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 4-nitrophenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3,5-dimethylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 4-chloro-2-methylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 4-isopropylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 2,3-dichlorophenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 2-biphenyl ester. 2,6-Difluorobenzoic acid, 4-benzyloxyphenyl ester.

Find more compounds similar to 2,6-Difluoro-3-methylbenzoic acid, 4-methoxyphenyl ester.

Sources

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