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

InChI

InChI=1S/C26H51NO4/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-30-25(28)24-27(3)26(29)31-22-7-5-2/h4-24H2,1-3H3

InChI Key

CDAKSSJKNOGRDZ-UHFFFAOYSA-N

Formula

C26H51NO4

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CN(C)C(=O)OCCCC

Molecular Weight¹

441.69

• 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).
• 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
ΔfG°	-189.02	kJ/mol	Joback Calculated Property
ΔfH°gas	-1002.04	kJ/mol	Joback Calculated Property
ΔfusH°	71.69	kJ/mol	Joback Calculated Property
ΔvapH°	93.83	kJ/mol	Joback Calculated Property
log10WS	-7.98		Crippen Calculated Property
logPoct/wat	7.660		Crippen Calculated Property
McVol	402.060	ml/mol	McGowan Calculated Property
Pc	761.42	kPa	Joback Calculated Property
Inp	[2833.00; 2833.00]
Inp	2833.00		NIST
Inp	2833.00		NIST
Tboil	959.30	K	Joback Calculated Property
Tc	1184.49	K	Joback Calculated Property
Tfus	559.57	K	Joback Calculated Property
Vc	1.558	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1390.27; 1495.71]	J/mol×K	[959.30; 1184.49]
Cp,gas	1390.27	J/mol×K	959.30	Joback Calculated Property
Cp,gas	1412.01	J/mol×K	996.83	Joback Calculated Property
Cp,gas	1431.99	J/mol×K	1034.36	Joback Calculated Property
Cp,gas	1450.29	J/mol×K	1071.90	Joback Calculated Property
Cp,gas	1466.96	J/mol×K	1109.43	Joback Calculated Property
Cp,gas	1482.08	J/mol×K	1146.96	Joback Calculated Property
Cp,gas	1495.71	J/mol×K	1184.49	Joback Calculated Property

Similar Compounds

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

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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