Chemical Properties of 2,6-Difluorobenzoic acid, heptyl ester

2,6-Difluorobenzoic acid, heptyl ester

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InChI
InChI=1S/C14H18F2O2/c1-2-3-4-5-6-10-18-14(17)13-11(15)8-7-9-12(13)16/h7-9H,2-6,10H2,1H3
InChI Key
CJGMKMQMUZMODB-UHFFFAOYSA-N
Formula
C14H18F2O2
SMILES
CCCCCCCOC(=O)c1c(F)cccc1F
Molecular Weight1
256.29
Sources

Physical Properties

Property Value Unit Source
Δf -463.39 kJ/mol Joback Calculated Property
Δfgas -755.72 kJ/mol Joback Calculated Property
Δfus 34.23 kJ/mol Joback Calculated Property
Δvap 57.88 kJ/mol Joback Calculated Property
logPoct/wat 4.09 Crippen Calculated Property
Pc 1882.17 kPa Joback Calculated Property
Tboil 631.19 K Joback Calculated Property
Tc 817.08 K Joback Calculated Property
Tfus 372.34 K Joback Calculated Property
Vc 0.77 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 509.59 J/mol×K 631.19 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 2
=CH- (ring) 3
=C< (ring) 3
-CH2- 6
>C=O (nonring) 1
-CH3 1

Similar Compounds

2,6-Difluorobenzoic acid, hexadecyl ester. 2,6-Difluorobenzoic acid, octadecyl ester. 2,6-Difluorobenzoic acid, hexyl ester. 2,6-Difluorobenzoic acid,2-tetradecyl ester. 2-Fluorobenzoic acid, 8-chlorooctyl ester. 2,6-Difluorobenzoic acid, 4-tridecyl ester. 2,6-Difluorobenzoic acid, 4-tetradecyl ester. 2,6-Difluorobenzoic acid, 3-pentadecyl ester. 2,4-Difluorobenzoic acid, 8-chlorooctyl ester. 2-Fluorobenzoic acid, butyl ester. 2-Fluorobenzoic acid, 2-methylpentyl ester. 2,4-Difluorobenzoic acid, 2-methylpentyl ester. 2,6-Difluorobenzoic acid, ethyl ester. 2-Fluorobenzoic acid, 3-methylbutyl ester. 2,4-Difluorobenzoic acid, 3-methylbutyl ester.

Find more compounds similar to 2,6-Difluorobenzoic acid, heptyl ester.

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