Chemical Properties of 5-Cyano-5-methyl-2-pyrrolidone (CAS 86240-21-3)

InChI

InChI=1S/C6H8N2O/c1-6(4-7)3-2-5(9)8-6/h2-3H2,1H3,(H,8,9)

InChI Key

BXKKJJWDNAORNS-UHFFFAOYSA-N

Formula

C6H8N2O

SMILES

CC1(C#N)CCC(=O)N1

Molecular Weight¹

124.14

CAS

86240-21-3

• 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).
• 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	[227.04; 287.50]	J/mol×K	[570.65; 824.57]
Cp,gas	227.04	J/mol×K	570.65	Joback Calculated Property
Cp,gas	238.31	J/mol×K	612.97	Joback Calculated Property
Cp,gas	248.96	J/mol×K	655.29	Joback Calculated Property
Cp,gas	259.09	J/mol×K	697.61	Joback Calculated Property
Cp,gas	268.82	J/mol×K	739.93	Joback Calculated Property
Cp,gas	278.25	J/mol×K	782.25	Joback Calculated Property
Cp,gas	287.50	J/mol×K	824.57	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5-Cyano-5-methyl-2-pyrrolidone.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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