Chemical Properties of 1-Aminocyclopentanecarboxylic acid, N-((1R)-(-)-menthyloxycarbonyl)-, dodecyl ester

InChI

InChI=1S/C29H53NO4/c1-5-6-7-8-9-10-11-12-13-16-21-33-27(31)29(19-14-15-20-29)30-28(32)34-26-22-24(4)17-18-25(26)23(2)3/h23-26H,5-22H2,1-4H3,(H,30,32)

InChI Key

AEUBGSANOZQKRL-UHFFFAOYSA-N

Formula

C29H53NO4

SMILES

CCCCCCCCCCCCOC(=O)C1(NC(=O)OC2CC(C)CCC2C(C)C)CCCC1

Molecular Weight¹

479.74

• 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	1.1185		Relay (... Calculated Property
ΔfG°	-147.50	kJ/mol	Joback Calculated Property
ΔfH°gas	-1171.15	kJ/mol	Relay (... Calculated Property
ΔfusH°	59.63	kJ/mol	Joback Calculated Property
ΔvapH°	136.26	kJ/mol	Relay (... Calculated Property
IE	8.93	eV	Relay (... Calculated Property
log10WS	-7.64		Relay (... Calculated Property
logPoct/wat	7.950		Crippen Calculated Property
McVol	422.610	ml/mol	McGowan Calculated Property
Pc	804.79	kPa	Joback Calculated Property
Inp	[3132.00; 3132.00]
Inp	3132.00		NIST
Inp	3132.00		NIST
Tboil	696.30	K	Relay (... Calculated Property
Tc	942.96	K	Relay (... Calculated Property
Tfus	334.50	K	Relay (... Calculated Property
Vc	1.540	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1618.98; 1768.41]	J/mol×K	[1090.96; 1339.44]
Cp,gas	1618.98	J/mol×K	1090.96	Joback Calculated Property
Cp,gas	1645.35	J/mol×K	1132.37	Joback Calculated Property
Cp,gas	1670.84	J/mol×K	1173.79	Joback Calculated Property
Cp,gas	1695.68	J/mol×K	1215.20	Joback Calculated Property
Cp,gas	1720.08	J/mol×K	1256.61	Joback Calculated Property
Cp,gas	1744.25	J/mol×K	1298.02	Joback Calculated Property
Cp,gas	1768.41	J/mol×K	1339.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Aminocyclopentanecarboxylic acid, N-((1R)-(-)-menthyloxycarbonyl)-, dodecyl ester.

Sources

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

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