Chemical Properties of L-Norvaline, N-(but-3-en-1-yloxycarbonyl)-, undecyl ester

InChI

InChI=1S/C21H39NO4/c1-4-7-9-10-11-12-13-14-15-18-25-20(23)19(16-6-3)22-21(24)26-17-8-5-2/h5,19H,2,4,6-18H2,1,3H3,(H,22,24)/t19-/m1/s1

InChI Key

ZUQLCUIQWGEWKG-LJQANCHMSA-N

Formula

C21H39NO4

SMILES

C=CCCOC(O)=NC(CCC)C(=O)OCCCCCCCCCCC

Molecular Weight¹

369.54

• 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	-813.44	kJ/mol	Joback Calculated Property
ΔvapH°	92.92	kJ/mol	Joback Calculated Property
log10WS	-6.01		Crippen Calculated Property
logPoct/wat	5.736		Crippen Calculated Property
McVol	327.310	ml/mol	McGowan Calculated Property
Pc	999.54	kPa	Joback Calculated Property
Inp	[2472.00; 2472.00]
Inp	2472.00		NIST
Inp	2472.00		NIST
Tboil	943.57	K	Joback Calculated Property
Tc	1156.81	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-Norvaline, N-(but-3-en-1-yloxycarbonyl)-, undecyl ester.

Sources

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

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