Chemical Properties of 2-Trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester

2-Trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester

InChI
InChI=1S/C14H6Cl3F3O2/c15-9-5-11(17)12(6-10(9)16)22-13(21)7-3-1-2-4-8(7)14(18,19)20/h1-6H
InChI Key
PSZXVCHECAWMAA-UHFFFAOYSA-N
Formula
C14H6Cl3F3O2
SMILES
O=C(Oc1cc(Cl)c(Cl)cc1Cl)c1ccccc1C(F)(F)F
Molecular Weight1
369.55
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Physical Properties

Property Value Unit Source
ΔfusH° 35.75 kJ/mol Joback Calculated Property
IE 9.06 eV Relay (1.0) Calculated Property
log10WS -6.25 Relay (1.0) Calculated Property
logPoct/wat 5.885 Crippen Calculated Property
McVol 210.070 ml/mol McGowan Calculated Property
Inp [2148.00; 2148.00]   Show Hide
Inp 2148.00 NIST
Inp 2148.00 NIST
Tboil 598.52 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 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 [504.89; 548.84] J/mol×K [776.16; 1010.79] Show Hide
Cp,gas 504.89 J/mol×K 776.16 Joback Calculated Property
Cp,gas 514.29 J/mol×K 815.26 Joback Calculated Property
Cp,gas 522.78 J/mol×K 854.37 Joback Calculated Property
Cp,gas 530.43 J/mol×K 893.47 Joback Calculated Property
Cp,gas 537.28 J/mol×K 932.58 Joback Calculated Property
Cp,gas 543.40 J/mol×K 971.68 Joback Calculated Property
Cp,gas 548.84 J/mol×K 1010.79 Joback Calculated Property

Similar Compounds

2-Trifluoromethylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 2-Trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 2-Trifluoromethylbenzoic acid, 2-chlorophenyl ester. Phthalic acid, di(2,4,5-trichlorophenyl) ester. 2-Trifluoromethylbenzoic acid, 4-chlorophenyl ester. 3-Trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 2,3-dichlorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3,4-dichlorophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2,3-dichlorophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-chlorophenyl ester. Phthalic acid, di(2,5-dichlorophenyl) ester. 3-Trifluoromethylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 4-chlorophenyl ester.

Find more compounds similar to 2-Trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester.

Sources

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