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

Fumaric acid, monoamide, N-(4-phenoxyphenyl)-, isopropyl ester

InChI
InChI=1S/C19H19NO4/c1-14(2)23-19(22)13-12-18(21)20-15-8-10-17(11-9-15)24-16-6-4-3-5-7-16/h3-14H,1-2H3,(H,20,21)/b13-12+
InChI Key
VNZLKYTVONWSFR-OUKQBFOZSA-N
Formula
C19H19NO4
SMILES
CC(C)OC(=O)C=CC(=O)Nc1ccc(Oc2ccccc2)cc1
Molecular Weight1
325.36
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Physical Properties

Property Value Unit Source
ΔfusH° 41.59 kJ/mol Joback Calculated Property
IE 7.77 eV Relay (1.0) Calculated Property
log10WS -4.68 Relay (1.0) Calculated Property
logPoct/wat 3.925 Crippen Calculated Property
McVol 251.610 ml/mol McGowan Calculated Property
Inp [2997.00; 2997.00]   Show Hide
Inp 2997.00 NIST
Inp 2997.00 NIST
Tfus 387.72 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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 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 [331.11; 781.94] 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 A-2.67000e+01
Coefficient B1.54764e+00
Coefficient C-9.16460e-04
Coefficient D1.77460e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 331.11 J/mol×K 273.00 Calculated Property
Cp,gas 413.98 J/mol×K 353.78 Calculated Property
Cp,gas 487.34 J/mol×K 434.56 Calculated Property
Cp,gas 551.75 J/mol×K 515.33 Calculated Property
Cp,gas 607.79 J/mol×K 596.11 Calculated Property
Cp,gas 656.01 J/mol×K 676.89 Calculated Property
Cp,gas 696.98 J/mol×K 757.67 Calculated Property
Cp,gas 731.25 J/mol×K 838.44 Calculated Property
Cp,gas 759.38 J/mol×K 919.22 Calculated Property
Cp,gas 781.94 J/mol×K 1000.00 Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-(4-phenoxyphenyl)-, neopentyl ester. Fumaric acid, monoamide, N-(4-phenoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, neopentyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, isopropyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-chlorophenyl ester.

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

Sources

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