Chemical Properties of 3-Chloro-2-fluorobenzoic acid, 3,4-dimethylphenyl ester

3-Chloro-2-fluorobenzoic acid, 3,4-dimethylphenyl ester

InChI
InChI=1S/C15H12ClFO2/c1-9-6-7-11(8-10(9)2)19-15(18)12-4-3-5-13(16)14(12)17/h3-8H,1-2H3
InChI Key
MIQSRGQRVLONOV-UHFFFAOYSA-N
Formula
C15H12ClFO2
SMILES
Cc1ccc(OC(=O)c2cccc(Cl)c2F)cc1C
Molecular Weight1
278.71
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Physical Properties

Property Value Unit Source
ΔfusH° 32.78 kJ/mol Joback Calculated Property
logPoct/wat 4.315 Crippen Calculated Property
McVol 196.140 ml/mol McGowan Calculated Property
Inp [2159.00; 2159.00]   Show Hide
Inp 2159.00 NIST
Inp 2159.00 NIST
Tfus 332.98 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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 [491.93; 556.72] J/mol×K [711.00; 942.34] Show Hide
Cp,gas 491.93 J/mol×K 711.00 Joback Calculated Property
Cp,gas 505.30 J/mol×K 749.56 Joback Calculated Property
Cp,gas 517.60 J/mol×K 788.11 Joback Calculated Property
Cp,gas 528.87 J/mol×K 826.67 Joback Calculated Property
Cp,gas 539.13 J/mol×K 865.23 Joback Calculated Property
Cp,gas 548.40 J/mol×K 903.78 Joback Calculated Property
Cp,gas 556.72 J/mol×K 942.34 Joback Calculated Property

Similar Compounds

3-Chloro-2-fluorobenzoic acid, 3-methylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 2,3-dimethylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 3,5-dimethylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-benzyloxyphenyl ester. 3-Chlorobenzoic acid, 3,4-dimethylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 3-ethylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-cyanophenyl ester. 3-Chloro-2-fluorobenzoic acid, phenylester. 6-Fluoro-3-trifluoromethylbenzoic acid, 3,4-dimethylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-chlorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-methoxyphenyl ester. 3,4-Dichlorobenzoic acid, 3,4-dimethylphenyl ester. 3-Chloro-2-fluorobenzoic acid, 4-isopropylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3,4-dimethylphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 3,4-dimethylphenyl ester.

Find more compounds similar to 3-Chloro-2-fluorobenzoic acid, 3,4-dimethylphenyl ester.

Sources

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