Chemical Properties of naepaine

InChI

InChI=1S/C14H22N2O2/c1-2-3-4-9-16-10-11-18-14(17)12-5-7-13(15)8-6-12/h5-8,16H,2-4,9-11,15H2,1H3

InChI Key

UYXHCVFXDBNRQW-UHFFFAOYSA-N

Formula

C14H22N2O2

SMILES

CCCCCNCCOC(=O)c1ccc(N)cc1

Molecular Weight¹

250.34

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[614.90; 689.37]	J/mol×K	[750.37; 958.84]
Cp,gas	614.90	J/mol×K	750.37	Joback Calculated Property
Cp,gas	629.61	J/mol×K	785.11	Joback Calculated Property
Cp,gas	643.36	J/mol×K	819.86	Joback Calculated Property
Cp,gas	656.19	J/mol×K	854.60	Joback Calculated Property
Cp,gas	668.11	J/mol×K	889.35	Joback Calculated Property
Cp,gas	679.16	J/mol×K	924.09	Joback Calculated Property
Cp,gas	689.37	J/mol×K	958.84	Joback Calculated Property

Similar Compounds

Find more compounds similar to naepaine.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method

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