Chemical Properties of 2-Aminopent-4-enoic acid, N-(2-benzyloxyetoxycarbonyl)-, nonyl ester

InChI

InChI=1S/C24H37NO5/c1-3-5-6-7-8-9-13-17-29-23(26)22(14-4-2)25-24(27)30-19-18-28-20-21-15-11-10-12-16-21/h4,10-12,15-16,22H,2-3,5-9,13-14,17-20H2,1H3,(H,25,27)

InChI Key

AKWCQIUGEOJNSW-UHFFFAOYSA-N

Formula

C24H37NO5

SMILES

C=CCC(N=C(O)OCCOCc1ccccc1)C(=O)OCCCCCCCCC

Molecular Weight¹

419.55

• 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	-771.05	kJ/mol	Joback Calculated Property
ΔvapH°	104.28	kJ/mol	Joback Calculated Property
log10WS	-5.95		Crippen Calculated Property
logPoct/wat	5.372		Crippen Calculated Property
McVol	351.690	ml/mol	McGowan Calculated Property
Pc	1016.18	kPa	Joback Calculated Property
Inp	[2998.00; 2998.00]
Inp	2998.00		NIST
Inp	2998.00		NIST
Tboil	1061.31	K	Joback Calculated Property
Tc	1304.00	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Aminopent-4-enoic acid, N-(2-benzyloxyetoxycarbonyl)-, nonyl ester.

Sources

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

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