Chemical Properties of Fumaric acid, 3,5-dichlorophenyl propyl ester

Fumaric acid, 3,5-dichlorophenyl propyl ester

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InChI
InChI=1S/C13H12Cl2O4/c1-2-5-18-12(16)3-4-13(17)19-11-7-9(14)6-10(15)8-11/h3-4,6-8H,2,5H2,1H3/b4-3+
InChI Key
GQDYWAPQBXUEDV-ONEGZZNKSA-N
Formula
C13H12Cl2O4
SMILES
CCCOC(=O)C=CC(=O)Oc1cc(Cl)cc(Cl)c1
Molecular Weight1
303.14
Sources

Physical Properties

Property Value Unit Source
Δf -259.75 kJ/mol Joback Calculated Property
Δfgas -501.92 kJ/mol Joback Calculated Property
Δfus 36.86 kJ/mol Joback Calculated Property
Δvap 75.17 kJ/mol Joback Calculated Property
logPoct/wat 3.41 Crippen Calculated Property
Pc 2278.41 kPa Joback Calculated Property
Tboil 765.08 K Joback Calculated Property
Tc 988.37 K Joback Calculated Property
Tfus 486.81 K Joback Calculated Property
Vc 0.78 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 510.22 J/mol×K 765.08 Joback Calculated Property
η 0.00 Pa×s 765.08 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Fumaric acid, butyl 3,5-dichlorophenyl ester. Fumaric acid, 3,5-dichlorophenyl ethyl ester. Fumaric acid, 3,5-dichlorophenyl heptyl ester. Fumaric acid, 3-methylbutyl 3-chlorophenyl ester. Fumaric acid, propyl 3,4,5-trichlorophenyl ester. Fumaric acid, butyl 3,4,5-trichlorophenyl ester. Fumaric acid, isobutyl 3,4,5-trichlorophenyl ester. Fumaric acid, 2-pentyl 3-chlorophenyl ester. Fumaric acid, hexyl 3,4,5-trichlorophenyl ester. Fumaric acid, di(3,5-dichlorophenyl) ester. Fumaric acid, 3-chlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-octyl 3-chlorophenyl ester. Fumaric acid, 3-phenylpropyl 3-chlorophenyl ester. Fumaric acid, butyl 2,3,5-trichlorophenyl ester. Fumaric acid, propyl 2,3,5,6-tetrachlorophenyl ester.

Find more compounds similar to Fumaric acid, 3,5-dichlorophenyl propyl ester.

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