Chemical Properties of Fumaric acid, monoamide, N,N-dimethyl-, 3,4-dimethylphenyl ester

Fumaric acid, monoamide, N,N-dimethyl-, 3,4-dimethylphenyl ester

InChI
InChI=1S/C14H17NO3/c1-10-5-6-12(9-11(10)2)18-14(17)8-7-13(16)15(3)4/h5-9H,1-4H3
InChI Key
HWVRSALFSZGLDI-BQYQJAHWSA-N
Formula
C14H17NO3
SMILES
Cc1ccc(OC(=O)/C=C/C(=O)N(C)C)cc1C
Molecular Weight1
247.29
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Physical Properties

Property Value Unit Source
ΔfusH° 34.47 kJ/mol Joback Calculated Property
log10WS -3.37 Relay (1.0) Calculated Property
logPoct/wat 1.853 Crippen Calculated Property
McVol 199.050 ml/mol McGowan Calculated Property
Inp [2286.00; 2286.00]   Show Hide
Inp 2286.00 NIST
Inp 2286.00 NIST
Tboil 585.96 K Relay (1.0) Calculated Property
Tfus 368.69 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 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 [269.09; 621.57] 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-7.25000e+00
Coefficient B1.19708e+00
Coefficient C-7.18020e-04
Coefficient D1.49760e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 269.09 J/mol×K 273.00 Calculated Property
Cp,gas 333.01 J/mol×K 353.78 Calculated Property
Cp,gas 389.65 J/mol×K 434.56 Calculated Property
Cp,gas 439.46 J/mol×K 515.33 Calculated Property
Cp,gas 482.92 J/mol×K 596.11 Calculated Property
Cp,gas 520.50 J/mol×K 676.89 Calculated Property
Cp,gas 552.69 J/mol×K 757.67 Calculated Property
Cp,gas 579.95 J/mol×K 838.44 Calculated Property
Cp,gas 602.75 J/mol×K 919.22 Calculated Property
Cp,gas 621.57 J/mol×K 1000.00 Calculated Property

Similar Compounds

Fumaric acid, monoamide, N,N-dimethyl-, 3-methylphenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-chloro-3-methylphenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-chloro-2-methylphenyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 3,4-dimethylphenyl ester. Fumaric acid, di(2,3-dimethylphenyl) ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 3-methylphenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-(2-phenylprop-2yl)phenyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 4-chloro-3-methylphenyl ester. Succinic acid, 2-methylphenyl 3,4-dimethylphenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-bromophenyl ester. Succinic acid, phenyl 3,4-dimethylphenyl ester. Fumaric acid, monoamide, N-(3,4-dimethoxyphenethyl)-, 3,5-difluorophenyl ester. trans-3-Trifluoromethylcinnamic acid, 3-methylphenyl ester. Succinic acid, 3,5-difluorophenyl 3,4-dimethylphenyl ester. Phenol, 3,4-dimethyl-, acetate.

Find more compounds similar to Fumaric acid, monoamide, N,N-dimethyl-, 3,4-dimethylphenyl ester.

Sources

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