Chemical Properties of Fumaric acid, monoamide, N,N-dimethyl-, 1-naphthyl ester

Fumaric acid, monoamide, N,N-dimethyl-, 1-naphthyl ester

InChI
InChI=1S/C16H15NO3/c1-17(2)15(18)10-11-16(19)20-14-9-5-7-12-6-3-4-8-13(12)14/h3-11H,1-2H3/b11-10+
InChI Key
LMABEVZVSHRUTH-ZHACJKMWSA-N
Formula
C16H15NO3
SMILES
CN(C)C(=O)/C=C/C(=O)Oc1cccc2ccccc12
Molecular Weight1
269.30
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Physical Properties

Property Value Unit Source
ΔfusH° 37.06 kJ/mol Joback Calculated Property
IE 8.23 eV Relay (1.0) Calculated Property
log10WS -3.68 Relay (1.0) Calculated Property
logPoct/wat 2.390 Crippen Calculated Property
McVol 207.770 ml/mol McGowan Calculated Property
Inp 2627.00 NIST
Tfus 401.82 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 [267.97; 637.01] 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-5.48100e+01
Coefficient B1.44284e+00
Coefficient C-1.03058e-03
Coefficient D2.79560e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 267.97 J/mol×K 273.00 Calculated Property
Cp,gas 339.03 J/mol×K 353.78 Calculated Property
Cp,gas 400.51 J/mol×K 434.56 Calculated Property
Cp,gas 453.30 J/mol×K 515.33 Calculated Property
Cp,gas 498.29 J/mol×K 596.11 Calculated Property
Cp,gas 536.34 J/mol×K 676.89 Calculated Property
Cp,gas 568.36 J/mol×K 757.67 Calculated Property
Cp,gas 595.22 J/mol×K 838.44 Calculated Property
Cp,gas 617.81 J/mol×K 919.22 Calculated Property
Cp,gas 637.01 J/mol×K 1000.00 Calculated Property

Similar Compounds

Fumaric acid, monoamide, N,N-dimethyl-, 2-naphthyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 3-chlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-bromophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 3-fluorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2-chlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2-fluorophenyl ester. Fumaric acid, di(naphth-1-yl) ester. Fumaric acid, monoamide, N,N-dimethyl-, 3-methylphenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-isopropoxyphenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2,5-dichlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2,3-dichlorophenyl ester. Fumaric acid, naphth-1-yl 3-chlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2-biphenyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 1-naphthyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 3,5-difluorophenyl ester.

Find more compounds similar to Fumaric acid, monoamide, N,N-dimethyl-, 1-naphthyl ester.

Sources

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