Chemical Properties of 1-Aminocyclopentanecarboxylic acid, N-(but-3-en-1-yloxycarbonyl)-, propyl ester

InChI

InChI=1S/C14H23NO4/c1-3-5-11-19-13(17)15-14(8-6-7-9-14)12(16)18-10-4-2/h3H,1,4-11H2,2H3,(H,15,17)

InChI Key

JDBJGYROYZDNKZ-UHFFFAOYSA-N

Formula

C14H23NO4

SMILES

C=CCCOC(=O)NC1(C(=O)OCCC)CCCC1

Molecular Weight¹

269.34

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.7210		Relay (... Calculated Property
ΔfG°	-192.55	kJ/mol	Joback Calculated Property
ΔfH°gas	-780.87	kJ/mol	Relay (... Calculated Property
ΔfusH°	29.05	kJ/mol	Joback Calculated Property
ΔvapH°	84.42	kJ/mol	Relay (... Calculated Property
IE	8.92	eV	Relay (... Calculated Property
log10WS	-3.18		Relay (... Calculated Property
logPoct/wat	2.555		Crippen Calculated Property
McVol	217.820	ml/mol	McGowan Calculated Property
Pc	2085.03	kPa	Joback Calculated Property
Inp	[1808.00; 1808.00]
Inp	1808.00		NIST
Inp	1808.00		NIST
Tboil	598.21	K	Relay (... Calculated Property
Tc	796.38	K	Relay (... Calculated Property
Tfus	290.59	K	Relay (... Calculated Property
Vc	0.762	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[642.47; 731.57]	J/mol×K	[734.67; 938.91]
Cp,gas	642.47	J/mol×K	734.67	Joback Calculated Property
Cp,gas	658.76	J/mol×K	768.71	Joback Calculated Property
Cp,gas	674.36	J/mol×K	802.75	Joback Calculated Property
Cp,gas	689.34	J/mol×K	836.79	Joback Calculated Property
Cp,gas	703.81	J/mol×K	870.83	Joback Calculated Property
Cp,gas	717.85	J/mol×K	904.87	Joback Calculated Property
Cp,gas	731.57	J/mol×K	938.91	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Aminocyclopentanecarboxylic acid, N-(but-3-en-1-yloxycarbonyl)-, propyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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