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

InChI

InChI=1S/C10H20N2O2/c1-6-8(2)9(10(13)14-5)11-7-12(3)4/h7-9H,6H2,1-5H3

InChI Key

AQZUPSFYTJWYPE-UHFFFAOYSA-N

Formula

C10H20N2O2

SMILES

CCC(C)C(N=CN(C)C)C(=O)OC

Molecular Weight¹

200.28

• 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	-355.34	kJ/mol	Joback Calculated Property
ΔvapH°	51.59	kJ/mol	Joback Calculated Property
log10WS	-0.97		Crippen Calculated Property
logPoct/wat	1.164		Crippen Calculated Property
McVol	174.860	ml/mol	McGowan Calculated Property
Pc	2023.58	kPa	Joback Calculated Property
Inp	[1374.00; 1374.00]
Inp	1374.00		NIST
Inp	1374.00		NIST
Tboil	592.73	K	Joback Calculated Property
Tc	785.90	K	Joback Calculated Property

Similar Compounds

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

Sources

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

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