Chemical Properties of L-Norvaline, N-octyloxycarbonyl-, decyl ester

InChI

InChI=1S/C24H47NO4/c1-4-7-9-11-13-14-16-17-20-28-23(26)22(19-6-3)25-24(27)29-21-18-15-12-10-8-5-2/h22H,4-21H2,1-3H3,(H,25,27)/t22-/m1/s1

InChI Key

GBOVKTJEDJIAQM-JOCHJYFZSA-N

Formula

C24H47NO4

SMILES

CCCCCCCCCCOC(=O)C(CCC)N=C(O)OCCCCCCCC

Molecular Weight¹

413.63

• 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	-1000.79	kJ/mol	Joback Calculated Property
ΔvapH°	100.27	kJ/mol	Joback Calculated Property
log10WS	-7.41		Crippen Calculated Property
logPoct/wat	7.130		Crippen Calculated Property
McVol	373.880	ml/mol	McGowan Calculated Property
Pc	819.60	kPa	Joback Calculated Property
Inp	[2784.00; 2784.00]
Inp	2784.00		NIST
Inp	2784.00		NIST
Tboil	1015.53	K	Joback Calculated Property
Tc	1258.49	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-Norvaline, N-octyloxycarbonyl-, decyl ester.

Sources

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

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