Chemical Properties of (3S)-(-)-3-Acetamidopyrrolidine (CAS 79286-74-1)

InChI

InChI=1S/C6H12N2O/c1-5(9)8-6-2-3-7-4-6/h6-7H,2-4H2,1H3,(H,8,9)/t6-/m0/s1

InChI Key

HDCCJUCOIKLZNM-LURJTMIESA-N

Formula

C6H12N2O

SMILES

CC(=O)NC1CCNC1

Molecular Weight¹

128.17

CAS

79286-74-1

• 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	[240.67; 312.50]	J/mol×K	[504.55; 723.58]
Cp,gas	240.67	J/mol×K	504.55	Joback Calculated Property
Cp,gas	254.49	J/mol×K	541.05	Joback Calculated Property
Cp,gas	267.55	J/mol×K	577.56	Joback Calculated Property
Cp,gas	279.86	J/mol×K	614.06	Joback Calculated Property
Cp,gas	291.44	J/mol×K	650.57	Joback Calculated Property
Cp,gas	302.32	J/mol×K	687.07	Joback Calculated Property
Cp,gas	312.50	J/mol×K	723.58	Joback Calculated Property

Similar Compounds

Find more compounds similar to (3S)-(-)-3-Acetamidopyrrolidine.

Sources

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

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