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

InChI

InChI=1S/C25H39NO5/c1-3-5-6-7-8-9-10-14-18-30-24(27)23(15-4-2)26-25(28)31-20-19-29-21-22-16-12-11-13-17-22/h4,11-13,16-17,23H,2-3,5-10,14-15,18-21H2,1H3,(H,26,28)

InChI Key

VMFOJBNCIYEODN-UHFFFAOYSA-N

Formula

C25H39NO5

SMILES

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

Molecular Weight¹

433.58

• 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	-791.69	kJ/mol	Joback Calculated Property
ΔvapH°	106.51	kJ/mol	Joback Calculated Property
log10WS	-6.37		Crippen Calculated Property
logPoct/wat	5.762		Crippen Calculated Property
McVol	365.780	ml/mol	McGowan Calculated Property
Pc	956.73	kPa	Joback Calculated Property
Inp	[3100.00; 3100.00]
Inp	3100.00		NIST
Inp	3100.00		NIST
Tboil	1084.19	K	Joback Calculated Property
Tc	1336.05	K	Joback Calculated Property

Similar Compounds

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

Sources

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

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