Chemical Properties of 6-Fluoro-3-trifluoromethylbenzoic acid, 4-chloro-2-methylphenyl ester

6-Fluoro-3-trifluoromethylbenzoic acid, 4-chloro-2-methylphenyl ester

InChI
InChI=1S/C15H9ClF4O2/c1-8-6-10(16)3-5-13(8)22-14(21)11-7-9(15(18,19)20)2-4-12(11)17/h2-7H,1H3
InChI Key
ZCANKODDYFBWAD-UHFFFAOYSA-N
Formula
C15H9ClF4O2
SMILES
Cc1cc(Cl)ccc1OC(=O)c1cc(C(F)(F)F)ccc1F
Molecular Weight1
332.68
Other Names
  • 6-Fluoro-3-trifluorobenzoic acid, 4-chloro-2-methylphenyl ester
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Physical Properties

Property Value Unit Source
ΔfusH° 34.60 kJ/mol Joback Calculated Property
log10WS -5.72 Relay (1.0) Calculated Property
logPoct/wat 5.026 Crippen Calculated Property
McVol 201.450 ml/mol McGowan Calculated Property
Inp [1882.00; 1882.00]   Show Hide
Inp 1882.00 NIST
Inp 1882.00 NIST
Tfus 341.06 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 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 [518.63; 576.16] J/mol×K [705.58; 920.20] Show Hide
Cp,gas 518.63 J/mol×K 705.58 Joback Calculated Property
Cp,gas 530.51 J/mol×K 741.35 Joback Calculated Property
Cp,gas 541.42 J/mol×K 777.12 Joback Calculated Property
Cp,gas 551.39 J/mol×K 812.89 Joback Calculated Property
Cp,gas 560.48 J/mol×K 848.66 Joback Calculated Property
Cp,gas 568.72 J/mol×K 884.43 Joback Calculated Property
Cp,gas 576.16 J/mol×K 920.20 Joback Calculated Property

Similar Compounds

6-Fluoro-3-trifluoromethylbenzoic acid, 3,4-dimethylphenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 4-chloro-2-methylphenyl ester. 6-Fluoro-3-trifluoromethylbenzoic acid, 2-formyl-4,6-dichlorophenyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid,4-chloro-2-methylphenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-chloro-2-methylphenyl ester. Dichlorophen, O,O'-di(3-trifluoromethylbenzoyl)-. Dichlorphen, O,O'-bis(2,4-difluorobenzoyl)-. 3-Chloro-2-fluorobenzoic acid, 2,3-dimethylphenyl ester. Dichlorophen, O-(3-trifluoromethylbenzoyl)-. Isophthalic acid, di(4-chloro-2-methylphenyl) ester. 6-Fluoro-3-trifluoromethylbenzoic acid, 2,3-dichlorophenyl ester. 6-Fluoro-3-trifluoromethylbenzoic acid, 4-isopropylphenyl ester. 2-Fluoro-3-trifluoromethylbenzoic acid, 3-methylphenyl ester. 2,4-Difluorobenzoic acid, 2,3-dimethylphenyl ester. Dichlorphen, O,O'-bis(3-Fluoro-4-trifluoromethylbenzoyl)-.

Find more compounds similar to 6-Fluoro-3-trifluoromethylbenzoic acid, 4-chloro-2-methylphenyl ester.

Sources

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