Chemical Properties of DL-3-Aminoisobutyric acid, N-dimethylaminomethylene-, ethyl ester

InChI

InChI=1S/C9H18N2O2/c1-5-13-9(12)8(2)6-10-7-11(3)4/h7-8H,5-6H2,1-4H3

InChI Key

MMQUJTWGIZSXTC-UHFFFAOYSA-N

Formula

C9H18N2O2

SMILES

CCOC(=O)C(C)CN=CN(C)C

Molecular Weight¹

186.25

• 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	-329.42	kJ/mol	Joback Calculated Property
ΔvapH°	49.75	kJ/mol	Joback Calculated Property
log10WS	-0.44		Crippen Calculated Property
logPoct/wat	0.775		Crippen Calculated Property
McVol	160.770	ml/mol	McGowan Calculated Property
Pc	2193.84	kPa	Joback Calculated Property
Inp	[1312.00; 1312.00]
Inp	1312.00		NIST
Inp	1312.00		NIST
Tboil	570.29	K	Joback Calculated Property
Tc	762.15	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to DL-3-Aminoisobutyric acid, N-dimethylaminomethylene-, ethyl ester.

Sources

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

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