Chemical Properties of Fumaric acid, monoamide, N,N-dimethyl-, 2,6-dichlorophenyl ester

Fumaric acid, monoamide, N,N-dimethyl-, 2,6-dichlorophenyl ester

InChI
InChI=1S/C12H11Cl2NO3/c1-15(2)10(16)6-7-11(17)18-12-8(13)4-3-5-9(12)14/h3-7H,1-2H3/b7-6+
InChI Key
IDKXXNKHJUIKRA-VOTSOKGWSA-N
Formula
C12H11Cl2NO3
SMILES
CN(C)C(=O)C=CC(=O)Oc1c(Cl)cccc1Cl
Molecular Weight1
288.13
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Physical Properties

Property Value Unit Source
ΔfusH° 37.68 kJ/mol Joback Calculated Property
IE 8.80 eV Relay (1.0) Calculated Property
logPoct/wat 2.543 Crippen Calculated Property
McVol 195.350 ml/mol McGowan Calculated Property
Inp [2305.00; 2305.00]   Show Hide
Inp 2305.00 NIST
Inp 2305.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, 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 [253.47; 534.93] 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 A2.03500e+01
Coefficient B1.02064e+00
Coefficient C-6.50020e-04
Coefficient D1.43960e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 253.47 J/mol×K 273.00 Calculated Property
Cp,gas 306.45 J/mol×K 353.78 Calculated Property
Cp,gas 352.94 J/mol×K 434.56 Calculated Property
Cp,gas 393.40 J/mol×K 515.33 Calculated Property
Cp,gas 428.28 J/mol×K 596.11 Calculated Property
Cp,gas 458.03 J/mol×K 676.89 Calculated Property
Cp,gas 483.12 J/mol×K 757.67 Calculated Property
Cp,gas 504.00 J/mol×K 838.44 Calculated Property
Cp,gas 521.11 J/mol×K 919.22 Calculated Property
Cp,gas 534.93 J/mol×K 1000.00 Calculated Property

Similar Compounds

Fumaric acid, monoamide, N,N-dimethyl-, 2,4,6-trichlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2-chlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2,3-dichlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2,5-dichlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 3-chlorophenyl ester. Fumaric acid, 2,6-dichlorophenyl 2,4,6-trichlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2-naphthyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2-fluorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 3-fluorophenyl ester. Fumaric acid, monoamide, N-allyl-, 2,4,6-trichlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 1-naphthyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 2,6-dichlorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 4-bromophenyl ester. Fumaric acid, 2,6-dichlorophenyl 3-chlorophenyl ester. Fumaric acid, di(2,3,6-trichlorophenyl) ester.

Find more compounds similar to Fumaric acid, monoamide, N,N-dimethyl-, 2,6-dichlorophenyl ester.

Sources

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