Chemical Properties of 2-Aminopent-4-enoic acid, N-decyloxycarbonyl-, isobutyl ester

InChI

InChI=1S/C20H37NO4/c1-5-7-8-9-10-11-12-13-15-24-20(23)21-18(14-6-2)19(22)25-16-17(3)4/h6,17-18H,2,5,7-16H2,1,3-4H3,(H,21,23)

InChI Key

AGMWPAMFYBYBFT-UHFFFAOYSA-N

Formula

C20H37NO4

SMILES

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

Molecular Weight¹

355.51

• 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	-798.08	kJ/mol	Joback Calculated Property
ΔvapH°	90.31	kJ/mol	Joback Calculated Property
log10WS	-5.35		Crippen Calculated Property
logPoct/wat	5.202		Crippen Calculated Property
McVol	313.220	ml/mol	McGowan Calculated Property
Pc	1068.66	kPa	Joback Calculated Property
Inp	[2315.00; 2315.00]
Inp	2315.00		NIST
Inp	2315.00		NIST
Tboil	920.25	K	Joback Calculated Property
Tc	1126.72	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Aminopent-4-enoic acid, N-decyloxycarbonyl-, isobutyl ester.

Sources

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

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