Chemical Properties of 2-Fluoro-6-trifluoromethylbenzoic acid, 4-methoxyphenyl ester

2-Fluoro-6-trifluoromethylbenzoic acid, 4-methoxyphenyl ester

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InChI
InChI=1S/C15H10F4O3/c1-21-9-5-7-10(8-6-9)22-14(20)13-11(15(17,18)19)3-2-4-12(13)16/h2-8H,1H3
InChI Key
WHLVMLCMPHPXDI-UHFFFAOYSA-N
Formula
C15H10F4O3
SMILES
COc1ccc(OC(=O)c2c(F)cccc2C(F)(F)F)cc1
Molecular Weight1
314.23
Sources

Physical Properties

Property Value Unit Source
Δf -843.97 kJ/mol Joback Calculated Property
Δfgas -1084.49 kJ/mol Joback Calculated Property
Δfus 30.40 kJ/mol Joback Calculated Property
Δvap 62.52 kJ/mol Joback Calculated Property
logPoct/wat 4.07 Crippen Calculated Property
Pc 2117.78 kPa Joback Calculated Property
Tboil 703.46 K Joback Calculated Property
Tc 913.82 K Joback Calculated Property
Tfus 448.38 K Joback Calculated Property
Vc 0.76 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 523.99 J/mol×K 703.46 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-F 4
=CH- (ring) 7
=C< (ring) 5
>C< 1
>C=O (nonring) 1
-CH3 1

Similar Compounds

2-Fluoro-6-trifluoromethylbenzoic acid, phenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 3,5-difluophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 4-nitrophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, phenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, phenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 4-cyanophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 3-methylphenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester. 2-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 2-Trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 2-Fluoro-6-(trifluoromethyl)benzoic acid. 4-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester.

Find more compounds similar to 2-Fluoro-6-trifluoromethylbenzoic acid, 4-methoxyphenyl ester.

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