Chemical Properties of L-Alanine, N-dimethylaminomethylene-, methyl ester

InChI

InChI=1S/C7H14N2O2/c1-6(7(10)11-4)8-5-9(2)3/h5-6H,1-4H3

InChI Key

NXWQXTNKKBBUNZ-UHFFFAOYSA-N

Formula

C7H14N2O2

SMILES

COC(=O)C(C)N=CN(C)C

Molecular Weight¹

158.20

• Δ_fH°_gas : Enthalpy of formation 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-288.14	kJ/mol	Joback Calculated Property
ΔvapH°	45.30	kJ/mol	Joback Calculated Property
log10WS	0.04		Crippen Calculated Property
logPoct/wat	0.138		Crippen Calculated Property
McVol	132.590	ml/mol	McGowan Calculated Property
Pc	2648.83	kPa	Joback Calculated Property
Inp	[1173.00; 1173.00]
Inp	1173.00		NIST
Inp	1173.00		NIST
Tboil	524.53	K	Joback Calculated Property
Tc	721.45	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-Alanine, N-dimethylaminomethylene-, methyl ester.

Sources

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

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