Chemical Properties of Glycine, 2-cyclohexyl-N-ethoxycarbonyl-, octadecyl ester

InChI

InChI=1S/C29H55NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-34-28(31)27(30-29(32)33-4-2)26-23-20-19-21-24-26/h26-27H,3-25H2,1-2H3,(H,30,32)

InChI Key

NJJUNYWHCRZBQW-UHFFFAOYSA-N

Formula

C29H55NO4

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(NC(=O)OCC)C1CCCCC1

Molecular Weight¹

481.75

• 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	1.2428		Relay (1.0) Calculated Property
ΔfG°	-163.14	kJ/mol	Joback Calculated Property
ΔfH°gas	-1210.43	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	69.85	kJ/mol	Joback Calculated Property
ΔvapH°	144.63	kJ/mol	Relay (1.0) Calculated Property
IE	9.24	eV	Relay (1.0) Calculated Property
log10WS	-8.19		Relay (1.0) Calculated Property
logPoct/wat	8.486		Crippen Calculated Property
McVol	433.470	ml/mol	McGowan Calculated Property
Pc	736.82	kPa	Joback Calculated Property
Inp	[2384.00; 2384.00]
Inp	2384.00		NIST
Inp	2384.00		NIST
Tboil	693.29	K	Relay (1.0) Calculated Property
Tc	911.97	K	Relay (1.0) Calculated Property
Tfus	345.99	K	Relay (1.0) Calculated Property
Vc	1.603	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1598.94; 1681.45]	J/mol×K	[1084.78; 1345.76]
Cp,gas	1598.94	J/mol×K	1084.78	Joback Calculated Property
Cp,gas	1618.59	J/mol×K	1128.28	Joback Calculated Property
Cp,gas	1635.73	J/mol×K	1171.77	Joback Calculated Property
Cp,gas	1650.48	J/mol×K	1215.27	Joback Calculated Property
Cp,gas	1662.94	J/mol×K	1258.77	Joback Calculated Property
Cp,gas	1673.22	J/mol×K	1302.26	Joback Calculated Property
Cp,gas	1681.45	J/mol×K	1345.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, 2-cyclohexyl-N-ethoxycarbonyl-, octadecyl ester.

Sources

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

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