Chemical Properties of N-(beta-cyanoethyl)glycine ethyl ester (CAS 44981-94-4)

InChI

InChI=1S/C7H12N2O2/c1-2-11-7(10)6-9-5-3-4-8/h9H,2-3,5-6H2,1H3

InChI Key

SBPUJTNHAUBDKF-UHFFFAOYSA-N

Formula

C7H12N2O2

SMILES

CCOC(=O)CNCCC#N

Molecular Weight¹

156.18

CAS

44981-94-4

• 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	[309.17; 362.21]	J/mol×K	[588.10; 784.37]
Cp,gas	309.17	J/mol×K	588.10	Joback Calculated Property
Cp,gas	319.19	J/mol×K	620.81	Joback Calculated Property
Cp,gas	328.73	J/mol×K	653.52	Joback Calculated Property
Cp,gas	337.80	J/mol×K	686.23	Joback Calculated Property
Cp,gas	346.41	J/mol×K	718.94	Joback Calculated Property
Cp,gas	354.54	J/mol×K	751.66	Joback Calculated Property
Cp,gas	362.21	J/mol×K	784.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to N-(beta-cyanoethyl)glycine ethyl ester.

Sources

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

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