Chemical Properties of Glycine, N-methyl-n-butoxycarbonyl-, hexadecyl ester

InChI

InChI=1S/C24H47NO4/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-21-28-23(26)22-25(3)24(27)29-20-7-5-2/h4-22H2,1-3H3

InChI Key

FGPJNAIHWLYDSC-UHFFFAOYSA-N

Formula

C24H47NO4

SMILES

CCCCCCCCCCCCCCCCOC(=O)CN(C)C(=O)OCCCC

Molecular Weight¹

413.63

• 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	1.2103		Relay (1.0) Calculated Property
ΔfG°	-205.86	kJ/mol	Joback Calculated Property
ΔfH°gas	-1107.11	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	66.51	kJ/mol	Joback Calculated Property
ΔvapH°	124.61	kJ/mol	Relay (1.0) Calculated Property
IE	9.10	eV	Relay (1.0) Calculated Property
log10WS	-6.29		Relay (1.0) Calculated Property
logPoct/wat	6.879		Crippen Calculated Property
McVol	373.880	ml/mol	McGowan Calculated Property
Pc	849.00	kPa	Joback Calculated Property
Inp	[2616.00; 2616.00]
Inp	2616.00		NIST
Inp	2616.00		NIST
Tboil	645.70	K	Relay (1.0) Calculated Property
Tc	833.59	K	Relay (1.0) Calculated Property
Tfus	294.65	K	Relay (1.0) Calculated Property
Vc	1.455	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1262.21; 1363.91]	J/mol×K	[913.54; 1121.26]
Cp,gas	1262.21	J/mol×K	913.54	Joback Calculated Property
Cp,gas	1282.67	J/mol×K	948.16	Joback Calculated Property
Cp,gas	1301.66	J/mol×K	982.78	Joback Calculated Property
Cp,gas	1319.24	J/mol×K	1017.40	Joback Calculated Property
Cp,gas	1335.44	J/mol×K	1052.02	Joback Calculated Property
Cp,gas	1350.31	J/mol×K	1086.64	Joback Calculated Property
Cp,gas	1363.91	J/mol×K	1121.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-methyl-n-butoxycarbonyl-, hexadecyl ester.

Sources

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

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