Chemical Properties of 1-Aminocyclopentanecarboxylic acid, N-(2-methoxyethoxycarbonyl)-, isobutyl ester

InChI

InChI=1S/C14H25NO5/c1-11(2)10-20-12(16)14(6-4-5-7-14)15-13(17)19-9-8-18-3/h11H,4-10H2,1-3H3,(H,15,17)

InChI Key

OSJLWJFVEUHYSJ-UHFFFAOYSA-N

Formula

C14H25NO5

SMILES

COCCOC(=O)NC1(C(=O)OCC(C)C)CCCC1

Molecular Weight¹

287.35

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion 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).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-387.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-830.20	kJ/mol	Joback Calculated Property
ΔfusH°	27.99	kJ/mol	Joback Calculated Property
ΔvapH°	72.63	kJ/mol	Joback Calculated Property
log10WS	-2.43		Crippen Calculated Property
logPoct/wat	1.871		Crippen Calculated Property
McVol	227.990	ml/mol	McGowan Calculated Property
Pc	1991.21	kPa	Joback Calculated Property
Inp	[1908.00; 1908.00]
Inp	1908.00		NIST
Inp	1908.00		NIST
Tboil	759.97	K	Joback Calculated Property
Tc	963.31	K	Joback Calculated Property
Tfus	486.55	K	Joback Calculated Property
Vc	0.854	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[696.72; 788.46]	J/mol×K	[759.97; 963.31]
Cp,gas	696.72	J/mol×K	759.97	Joback Calculated Property
Cp,gas	713.57	J/mol×K	793.86	Joback Calculated Property
Cp,gas	729.70	J/mol×K	827.75	Joback Calculated Property
Cp,gas	745.18	J/mol×K	861.64	Joback Calculated Property
Cp,gas	760.08	J/mol×K	895.53	Joback Calculated Property
Cp,gas	774.48	J/mol×K	929.42	Joback Calculated Property
Cp,gas	788.46	J/mol×K	963.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Aminocyclopentanecarboxylic acid, N-(2-methoxyethoxycarbonyl)-, isobutyl ester.

Sources

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

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