Chemical Properties of 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, pentyl ester

InChI

InChI=1S/C15H26ClNO4/c1-2-3-6-11-20-13(18)15(8-4-5-9-15)17-14(19)21-12-7-10-16/h2-12H2,1H3,(H,17,19)

InChI Key

ZJCMRCUOISUGBR-UHFFFAOYSA-N

Formula

C15H26ClNO4

SMILES

CCCCCOC(=O)C1(NC(=O)OCCCCl)CCCC1

Molecular Weight¹

319.82

• 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°	-283.90	kJ/mol	Joback Calculated Property
ΔfH°gas	-729.08	kJ/mol	Joback Calculated Property
ΔfusH°	37.11	kJ/mol	Joback Calculated Property
ΔvapH°	77.22	kJ/mol	Joback Calculated Property
log10WS	-4.15		Crippen Calculated Property
logPoct/wat	3.388		Crippen Calculated Property
McVol	248.450	ml/mol	McGowan Calculated Property
Pc	1787.88	kPa	Joback Calculated Property
Inp	[2170.00; 2170.00]
Inp	2170.00		NIST
Inp	2170.00		NIST
Tboil	798.30	K	Joback Calculated Property
Tc	1002.19	K	Joback Calculated Property
Tfus	520.51	K	Joback Calculated Property
Vc	0.947	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[753.27; 844.93]	J/mol×K	[798.30; 1002.19]
Cp,gas	753.27	J/mol×K	798.30	Joback Calculated Property
Cp,gas	769.80	J/mol×K	832.28	Joback Calculated Property
Cp,gas	785.71	J/mol×K	866.26	Joback Calculated Property
Cp,gas	801.08	J/mol×K	900.24	Joback Calculated Property
Cp,gas	816.01	J/mol×K	934.23	Joback Calculated Property
Cp,gas	830.60	J/mol×K	968.21	Joback Calculated Property
Cp,gas	844.93	J/mol×K	1002.19	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, pentyl ester.

Sources

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

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