Chemical Properties of 3-Fluoro-4-trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester

3-Fluoro-4-trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester

InChI
InChI=1S/C14H5Cl3F4O2/c15-8-4-10(17)12(5-9(8)16)23-13(22)6-1-2-7(11(18)3-6)14(19,20)21/h1-5H
InChI Key
KKORITHVGLTYGK-UHFFFAOYSA-N
Formula
C14H5Cl3F4O2
SMILES
O=C(Oc1cc(Cl)c(Cl)cc1Cl)c1ccc(C(F)(F)F)c(F)c1
Molecular Weight1
387.54
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Physical Properties

Property Value Unit Source
Δfus 40.02 kJ/mol Joback Calculated Property
logPoct/wat 6.024 Crippen Calculated Property
McVol 211.840 ml/mol McGowan Calculated Property
Inp 2092.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [509.18; 550.48] J/mol×K [762.54; 987.22] Show Hide
Cp,gas 509.18 J/mol×K 762.54 Joback Calculated Property
Cp,gas 518.14 J/mol×K 799.99 Joback Calculated Property
Cp,gas 526.21 J/mol×K 837.43 Joback Calculated Property
Cp,gas 533.43 J/mol×K 874.88 Joback Calculated Property
Cp,gas 539.86 J/mol×K 912.33 Joback Calculated Property
Cp,gas 545.52 J/mol×K 949.77 Joback Calculated Property
Cp,gas 550.48 J/mol×K 987.22 Joback Calculated Property

Similar Compounds

3-Fluoro-4-trifluoromethylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2,3-dichlorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 4-chlorophenyl ester. 3-Fluorobenzoic acid, 2,4,5-trichlorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2,4-dichloronaphth-1-yl ester. 2-Fluorobenzoic acid, 2,4,5-trichlorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2,4-dichloro-6-formylphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, phenyl ester. 2,4-Difluorobenzoic acid, 2,4,5-trichlorophenyl ester. 4-Fluorobenzoic acid, 2,4,5-trichlorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 3-fluorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 4-cyanophenyl ester. 3-Fluorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester.

Find more compounds similar to 3-Fluoro-4-trifluoromethylbenzoic acid, 2,4,5-trichlorophenyl ester.

Sources

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