Chemical Properties of 1-Aminocyclopentanecarboxylic acid, N-hexyloxycarbonyl-, heptyl ester

InChI

InChI=1S/C20H37NO4/c1-3-5-7-9-13-16-24-18(22)20(14-10-11-15-20)21-19(23)25-17-12-8-6-4-2/h3-17H2,1-2H3,(H,21,23)

InChI Key

OPUSZINVBJDFFH-UHFFFAOYSA-N

Formula

C20H37NO4

SMILES

CCCCCCCOC(=O)C1(N=C(O)OCCCCCC)CCCC1

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	-837.23	kJ/mol	Joback Calculated Property
ΔvapH°	90.86	kJ/mol	Joback Calculated Property
log10WS	-5.63		Crippen Calculated Property
logPoct/wat	5.324		Crippen Calculated Property
McVol	306.660	ml/mol	McGowan Calculated Property
Pc	1195.65	kPa	Joback Calculated Property
Inp	[2450.00; 2450.00]
Inp	2450.00		NIST
Inp	2450.00		NIST
Tboil	939.97	K	Joback Calculated Property
Tc	1151.31	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Aminocyclopentanecarboxylic acid, N-hexyloxycarbonyl-, heptyl ester.

Sources

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

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