Chemical Properties of 2,4-Difluorobenzoic acid, isopropyl ester

2,4-Difluorobenzoic acid, isopropyl ester

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InChI
InChI=1S/C10H10F2O2/c1-6(2)14-10(13)8-4-3-7(11)5-9(8)12/h3-6H,1-2H3
InChI Key
LFUCJHJJKQCTNX-UHFFFAOYSA-N
Formula
C10H10F2O2
SMILES
CC(C)OC(=O)c1ccc(F)cc1F
Molecular Weight1
200.18
Sources

Physical Properties

Property Value Unit Source
Δf -499.51 kJ/mol Joback Calculated Property
Δfgas -678.44 kJ/mol Joback Calculated Property
Δfus 20.34 kJ/mol Joback Calculated Property
Δvap 48.59 kJ/mol Joback Calculated Property
logPoct/wat 2.53 Crippen Calculated Property
Pc 2732.56 kPa Joback Calculated Property
Tboil 539.23 K Joback Calculated Property
Tc 737.94 K Joback Calculated Property
Tfus 312.26 K Joback Calculated Property
Vc 0.54 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 316.87 J/mol×K 539.23 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2,4-Difluorobenzoic acid, 3-methylbutyl-2 ester. 2,4-Difluorobenzoic acid, 2-pentyl ester. 2,4-Difluorobenzoic acid, neopentyl ester. 2,4-Difluorobenzoic acid, 3-methylbutyl ester. 2,4-Difluorobenzoic acid, 2,2,2-trichloroethyl ester. 2,6-Difluorobenzoic acid, ethyl ester. Ethyl 2-fluorobenzoate. 2,6-Difluorobenzoic acid, but-3-yn-2-yl ester. 2,4-Difluorobenzoic acid, 2-methylpentyl ester. 2,4-Difluorobenzoic acid, 8-chlorooctyl ester. 2,4-Difluorobenzoic acid, 4-methoxy-2-methylbutyl ester. Propyl 2-fluorobenzoate. 2,5-Difluorobenzoic acid, isopropyl ester. 2,4-Difluorobenzoic acid, 2-ethylhexyl ester. 2-Fluorobenzoic acid, butyl ester.

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