Chemical Properties of Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, isopropyl ester

Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, isopropyl ester

InChI
InChI=1S/C15H19NO5/c1-10(2)21-15(18)8-7-14(17)16-12-6-5-11(19-3)9-13(12)20-4/h5-10H,1-4H3,(H,16,17)/b8-7+
InChI Key
KFNWBZQRZYKFHT-BQYQJAHWSA-N
Formula
C15H19NO5
SMILES
COc1ccc(NC(=O)/C=C/C(=O)OC(C)C)c(OC)c1
Molecular Weight1
293.32
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Physical Properties

Property Value Unit Source
ΔfusH° 37.99 kJ/mol Joback Calculated Property
logPoct/wat 2.150 Crippen Calculated Property
McVol 224.880 ml/mol McGowan Calculated Property
Inp 2541.00 NIST
Tboil 618.37 K Relay (1.0) Calculated Property
Tfus 391.40 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [321.47; 709.56] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A5.06400e+01
Coefficient B1.12388e+00
Coefficient C-4.89620e-04
Coefficient D2.46600e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 321.47 J/mol×K 273.00 Calculated Property
Cp,gas 388.06 J/mol×K 353.78 Calculated Property
Cp,gas 448.59 J/mol×K 434.56 Calculated Property
Cp,gas 503.16 J/mol×K 515.33 Calculated Property
Cp,gas 551.84 J/mol×K 596.11 Calculated Property
Cp,gas 594.70 J/mol×K 676.89 Calculated Property
Cp,gas 631.82 J/mol×K 757.67 Calculated Property
Cp,gas 663.29 J/mol×K 838.44 Calculated Property
Cp,gas 689.18 J/mol×K 919.22 Calculated Property
Cp,gas 709.56 J/mol×K 1000.00 Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, neopentyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 3-fluorophenyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-chlorophenyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, neopentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 4-isopropoxyphenyl ester. Fumaric acid, monoamide, N-(4-phenoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2,4,6-trichlorophenyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2-fluorophenyl ester. Fumaric acid, monoamide, N-(4-phenoxyphenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2-methoxy-5-chlorophenyl)-, 4-bromophenyl ester. Glutaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, butyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, pentafluorobenzyl ester.

Find more compounds similar to Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, isopropyl ester.

Sources

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