Chemical Properties of Fumaric acid, monoamide, N-(2-ethylphenyl)-, 4-chloro-2-methylphenyl ester

Fumaric acid, monoamide, N-(2-ethylphenyl)-, 4-chloro-2-methylphenyl ester

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InChI
InChI=1S/C19H18ClNO3/c1-3-14-6-4-5-7-16(14)21-18(22)10-11-19(23)24-17-9-8-15(20)12-13(17)2/h4-12H,3H2,1-2H3,(H,21,22)/b11-10+
InChI Key
ZNQKRUXQBCNWHG-ZHACJKMWSA-N
Formula
C19H18ClNO3
SMILES
CCc1ccccc1NC(=O)C=CC(=O)Oc1ccc(Cl)cc1C
Molecular Weight1
343.80
Sources

Physical Properties

Property Value Unit Source
Δf 99.87 kJ/mol Joback Calculated Property
Δfgas -199.27 kJ/mol Joback Calculated Property
Δfus 45.77 kJ/mol Joback Calculated Property
Δvap 91.11 kJ/mol Joback Calculated Property
logPoct/wat 4.31 Crippen Calculated Property
Pc 1910.24 kPa Joback Calculated Property
Tboil 924.34 K Joback Calculated Property
Tc 1162.79 K Joback Calculated Property
Tfus 593.88 K Joback Calculated Property
Vc 0.98 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 742.84 J/mol×K 924.34 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 1
=CH- (ring) 7
=C< (ring) 5
-CH2- 1
=CH- 2
>NH 1
>C=O (nonring) 2
-CH3 2

Similar Compounds

Fumaric acid, monoamide, N-methyl-N-phenyl-, 4-chloro-2-methylphenyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 3-fluorophenyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 3,5-fluorophenyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-fluorophenyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 4-chloro-2-methylphenyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 4-chloro-3-methylphenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-chloro-2-methylphenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 4-chloro-3-methylphenyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, neopentyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-chlorophenyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 2,4,6-trichlorophenyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 3-fluorophenyl ester.

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