Chemical Properties of 2,4-Difluorobenzoic acid, 3-methylbutyl-2 ester

2,4-Difluorobenzoic acid, 3-methylbutyl-2 ester

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InChI
InChI=1S/C12H14F2O2/c1-7(2)8(3)16-12(15)10-5-4-9(13)6-11(10)14/h4-8H,1-3H3
InChI Key
CHECDZKHGXJPLQ-UHFFFAOYSA-N
Formula
C12H14F2O2
SMILES
CC(C)C(C)OC(=O)c1ccc(F)cc1F
Molecular Weight1
228.24
Sources

Physical Properties

Property Value Unit Source
Δf -485.11 kJ/mol Joback Calculated Property
Δfgas -725.00 kJ/mol Joback Calculated Property
Δfus 22.00 kJ/mol Joback Calculated Property
Δvap 52.65 kJ/mol Joback Calculated Property
logPoct/wat 3.17 Crippen Calculated Property
Pc 2274.07 kPa Joback Calculated Property
Tboil 584.55 K Joback Calculated Property
Tc 781.81 K Joback Calculated Property
Tfus 319.80 K Joback Calculated Property
Vc 0.65 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 410.56 J/mol×K 584.55 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2,4-Difluorobenzoic acid, 2-pentyl ester. 2-Fluorobenzoic acid, 3-methylbut-2-yl ester. 2,4-Difluorobenzoic acid, neopentyl ester. 2,4-Difluorobenzoic acid, isopropyl ester. 2,4-Difluorobenzoic acid, 2-methylpentyl ester. 2,4-Difluorobenzoic acid, 3-methylbutyl ester. 2,4-Difluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 2,4-Difluorobenzoic acid, 2-ethylhexyl ester. 2,4-Difluorobenzoic acid, 8-chlorooctyl ester. 1,2-dimethylpropyl pentafluorobenzoate. 2,6-Difluorobenzoic acid,2-tetradecyl ester. 2,6-Difluorobenzoic acid, 4-tridecyl ester. 2,6-Difluorobenzoic acid, 4-tetradecyl ester. 2,6-Difluorobenzoic acid, 3-pentadecyl ester. Propyl 2-fluorobenzoate.

Find more compounds similar to 2,4-Difluorobenzoic acid, 3-methylbutyl-2 ester.

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