Chemical Properties of Benzamide, 2-chloro-n-(cyanomethyl)-n-cyclohexyl-4-nitro- (CAS 22977-95-3)

Benzamide, 2-chloro-n-(cyanomethyl)-n-cyclohexyl-4-nitro-

InChI
InChI=1S/C15H16ClN3O3/c16-14-10-12(19(21)22)6-7-13(14)15(20)18(9-8-17)11-4-2-1-3-5-11/h6-7,10-11H,1-5,9H2
InChI Key
DUKMGBUPFGNRBQ-UHFFFAOYSA-N
Formula
C15H16ClN3O3
SMILES
N#CCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1
Molecular Weight1
321.76
CAS
22977-95-3
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Physical Properties

Property Value Unit Source
ΔfusH° 41.39 kJ/mol Joback Calculated Property
logPoct/wat 3.547 Crippen Calculated Property
McVol 230.180 ml/mol McGowan Calculated Property

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, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [700.83; 749.87] J/mol×K [956.65; 1216.94] Show Hide
Cp,gas 700.83 J/mol×K 956.65 Joback Calculated Property
Cp,gas 711.70 J/mol×K 1000.03 Joback Calculated Property
Cp,gas 721.36 J/mol×K 1043.41 Joback Calculated Property
Cp,gas 729.90 J/mol×K 1086.79 Joback Calculated Property
Cp,gas 737.44 J/mol×K 1130.18 Joback Calculated Property
Cp,gas 744.06 J/mol×K 1173.56 Joback Calculated Property
Cp,gas 749.87 J/mol×K 1216.94 Joback Calculated Property

Similar Compounds

Benzamide, n-butyl-2-chloro-n-cyanomethyl-4-nitro-. Benzamide, 2-chloro-n-cyanomethyl-n-cyclopropyl-4-nitro-. Norhydrocodone. Metergoline. 3'-trans-cinnamoylindicine. 3'-cis-cinnamoylindicine. L-Proline, N-(2,4-difluorobenzoyl)-, decyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, octadecyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, tetradecyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, heptadecyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, undecyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, hexadecyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, pentadecyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, octyl ester. L-Proline, N-(2,4-difluorobenzoyl)-, dodecyl ester.

Find more compounds similar to Benzamide, 2-chloro-n-(cyanomethyl)-n-cyclohexyl-4-nitro-.

Sources

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