Chemical Properties of Aniline, n,2-dicyclohexyl-4-methyl-

InChI

InChI=1S/C19H29N/c1-15-12-13-19(20-17-10-6-3-7-11-17)18(14-15)16-8-4-2-5-9-16/h12-14,16-17,20H,2-11H2,1H3

InChI Key

XVGGVVJOFYICSW-UHFFFAOYSA-N

Formula

C19H29N

SMILES

Cc1ccc(NC2CCCCC2)c(C2CCCCC2)c1

Molecular Weight¹

271.44

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[296.34; 881.99]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.52110e+02
Coefficient B			1.93132e+00
Coefficient C			-1.11752e-03
Coefficient D			2.20300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	296.34	J/mol×K	273.00	Calculated Property
Cp,gas	401.04	J/mol×K	353.78	Calculated Property
Cp,gas	494.20	J/mol×K	434.56	Calculated Property
Cp,gas	576.53	J/mol×K	515.33	Calculated Property
Cp,gas	648.73	J/mol×K	596.11	Calculated Property
Cp,gas	711.48	J/mol×K	676.89	Calculated Property
Cp,gas	765.48	J/mol×K	757.67	Calculated Property
Cp,gas	811.44	J/mol×K	838.44	Calculated Property
Cp,gas	850.04	J/mol×K	919.22	Calculated Property
Cp,gas	881.99	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Aniline, n,2-dicyclohexyl-4-methyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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