Chemical Properties of 3-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester

3-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester

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InChI
InChI=1S/C21H15F3O3/c22-21(23,24)17-8-4-7-16(13-17)20(25)27-19-11-9-18(10-12-19)26-14-15-5-2-1-3-6-15/h1-13H,14H2
InChI Key
KTHPIWRLODIPDU-UHFFFAOYSA-N
Formula
C21H15F3O3
SMILES
O=C(Oc1ccc(OCc2ccccc2)cc1)c1cccc(C(F)(F)F)c1
Molecular Weight1
372.34
Sources

Physical Properties

Property Value Unit Source
Δf -476.60 kJ/mol Joback Calculated Property
Δfgas -764.22 kJ/mol Joback Calculated Property
Δfus 37.29 kJ/mol Joback Calculated Property
Δvap 78.31 kJ/mol Joback Calculated Property
logPoct/wat 5.50 Crippen Calculated Property
Pc 1798.51 kPa Joback Calculated Property
Tboil 863.17 K Joback Calculated Property
Tc 1097.39 K Joback Calculated Property
Tfus 529.31 K Joback Calculated Property
Vc 0.97 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 749.82 J/mol×K 863.17 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-F 3
=CH- (ring) 13
=C< (ring) 5
-CH2- 1
>C< 1
>C=O (nonring) 1

Similar Compounds

3-Trifluoromethylbenzoic acid, phenyl ester. 3-Trifluoromethylbenzoic acid, 4-chlorophenyl ester. 3-Trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester. 3-Trifluoromethylbenzoic acid, 4-cyanophenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 4-methoxyphenyl ester. M-toluic acid, 4-methoxyphenyl ester. m-Toluic acid, 4-benzyloxyphenyl ester. 3-Trifluoromethylbenzoic acid, 2-chlorophenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, phenyl ester. 2,5-Ditrifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 4-Trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 4-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 3-fluorophenyl ester. 3-Trifluoromethylbenzoic acid, 2-isopropoxyphenyl ester. Diphenyl isophthalate.

Find more compounds similar to 3-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester.

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