Chemical Properties of Valeramide, n-cyclohexyl-2,2,4-trimethyl-3-oxo-

InChI

InChI=1S/C14H25NO2/c1-10(2)12(16)14(3,4)13(17)15-11-8-6-5-7-9-11/h10-11H,5-9H2,1-4H3,(H,15,17)

InChI Key

YUYDQLGDIIVEKR-UHFFFAOYSA-N

Formula

C14H25NO2

SMILES

CC(C)C(=O)C(C)(C)C(=O)NC1CCCCC1

Molecular Weight¹

239.36

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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 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	[280.62; 743.61]	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			-8.80900e+01
Coefficient B			1.60788e+00
Coefficient C			-1.00500e-03
Coefficient D			2.28820e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	280.62	J/mol×K	273.00	Calculated Property
Cp,gas	365.09	J/mol×K	353.78	Calculated Property
Cp,gas	439.62	J/mol×K	434.56	Calculated Property
Cp,gas	504.92	J/mol×K	515.33	Calculated Property
Cp,gas	561.73	J/mol×K	596.11	Calculated Property
Cp,gas	610.76	J/mol×K	676.89	Calculated Property
Cp,gas	652.74	J/mol×K	757.67	Calculated Property
Cp,gas	688.39	J/mol×K	838.44	Calculated Property
Cp,gas	718.44	J/mol×K	919.22	Calculated Property
Cp,gas	743.61	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Valeramide, n-cyclohexyl-2,2,4-trimethyl-3-oxo-.

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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