Chemical Properties of O-Benzyl-L-serine, N-dimethylaminomethylene-, ethyl ester

InChI

InChI=1S/C15H22N2O3/c1-4-20-15(18)14(16-12-17(2)3)11-19-10-13-8-6-5-7-9-13/h5-9,12,14H,4,10-11H2,1-3H3

InChI Key

ZMJYEGXYBLHNQT-UHFFFAOYSA-N

Formula

C15H22N2O3

SMILES

CCOC(=O)C(COCc1ccccc1)N=CN(C)C

Molecular Weight¹

278.35

• 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	-348.95	kJ/mol	Joback Calculated Property
ΔvapH°	67.80	kJ/mol	Joback Calculated Property
log10WS	-1.99		Crippen Calculated Property
logPoct/wat	1.725		Crippen Calculated Property
McVol	227.420	ml/mol	McGowan Calculated Property
Pc	1740.46	kPa	Joback Calculated Property
Inp	[2033.00; 2033.00]
Inp	2033.00		NIST
Inp	2033.00		NIST
Tboil	756.67	K	Joback Calculated Property
Tc	966.84	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to O-Benzyl-L-serine, N-dimethylaminomethylene-, ethyl ester.

Sources

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

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