Chemical Properties of 4-Fluorobenzoic acid, 3-methylphenyl ester

4-Fluorobenzoic acid, 3-methylphenyl ester

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InChI
InChI=1S/C14H11FO2/c1-10-3-2-4-13(9-10)17-14(16)11-5-7-12(15)8-6-11/h2-9H,1H3
InChI Key
KUXHTJXGSFNEBU-UHFFFAOYSA-N
Formula
C14H11FO2
SMILES
Cc1cccc(OC(=O)c2ccc(F)cc2)c1
Molecular Weight1
230.23
Sources

Physical Properties

Property Value Unit Source
Δf -156.17 kJ/mol Joback Calculated Property
Δfgas -323.08 kJ/mol Joback Calculated Property
Δfus 25.19 kJ/mol Joback Calculated Property
Δvap 60.97 kJ/mol Joback Calculated Property
logPoct/wat 3.35 Crippen Calculated Property
Pc 2687.42 kPa Joback Calculated Property
Tboil 658.60 K Joback Calculated Property
Tc 891.72 K Joback Calculated Property
Tfus 398.17 K Joback Calculated Property
Vc 0.65 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 422.07 J/mol×K 658.6 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 1
=CH- (ring) 8
=C< (ring) 4
>C=O (nonring) 1
-CH3 1

Similar Compounds

4-Fluorobenzoic acid, 3,5-dimethylphenyl ester. 4-Fluorobenzoic acid, phenyl ester. Benzoic acid, 3-methylphenyl ester. 4-Fluorobenzoic acid, 4-benzyloxyphenyl ester. Benzoic acid, 4-fluoro-, 4-methoxyphenyl ester. 3-Fluorobenzoic acid, 3-methylphenyl ester. 3,4-Difluorobenzoic acid, 3-methylphenyl ester. p-Toluylic acid, 3-methylphenyl ester. p-Anisic acid, 3-methylphenyl ester. 3-Fluorobenzoic acid, 3,5-dimethylphenyl ester. 4-Fluorobenzoic acid, 2,3-dimethylphenyl ester. 3,4-Difluorobenzoic acid, 3,5-dimethylphenyl ester. Benzoic acid, 3-ethylphenyl ester. P-toluic acid, 3,5-dimethylphenyl ester. 4-Fluorobenzoic acid, 2-methylphenyl ester.

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