Chemical Properties of Glycine, N-methyl-N-methoxycarbonyl-, hexadecyl ester

InChI

InChI=1S/C21H41NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-20(23)19-22(2)21(24)25-3/h4-19H2,1-3H3

InChI Key

XRJRABOQHOYWOL-UHFFFAOYSA-N

Formula

C21H41NO4

SMILES

CCCCCCCCCCCCCCCCOC(=O)CN(C)C(=O)OC

Molecular Weight¹

371.55

• 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	1.1028		Relay (1.0) Calculated Property
ΔfG°	-231.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-1036.32	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	58.74	kJ/mol	Joback Calculated Property
ΔvapH°	118.38	kJ/mol	Relay (1.0) Calculated Property
IE	9.13	eV	Relay (1.0) Calculated Property
log10WS	-5.60		Relay (1.0) Calculated Property
logPoct/wat	5.709		Crippen Calculated Property
McVol	331.610	ml/mol	McGowan Calculated Property
Pc	1011.66	kPa	Joback Calculated Property
Inp	[2433.00; 2433.00]
Inp	2433.00		NIST
Inp	2433.00		NIST
Tboil	622.33	K	Relay (1.0) Calculated Property
Tc	813.72	K	Relay (1.0) Calculated Property
Tfus	307.96	K	Relay (1.0) Calculated Property
Vc	1.288	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1074.03; 1170.46]	J/mol×K	[844.90; 1034.56]
Cp,gas	1074.03	J/mol×K	844.90	Joback Calculated Property
Cp,gas	1092.91	J/mol×K	876.51	Joback Calculated Property
Cp,gas	1110.63	J/mol×K	908.12	Joback Calculated Property
Cp,gas	1127.22	J/mol×K	939.73	Joback Calculated Property
Cp,gas	1142.70	J/mol×K	971.34	Joback Calculated Property
Cp,gas	1157.10	J/mol×K	1002.95	Joback Calculated Property
Cp,gas	1170.46	J/mol×K	1034.56	Joback Calculated Property

Similar Compounds

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

Sources

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

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