Chemical Properties of Carbonic acid, monoamide, N-octadecyl-, octyl ester

InChI

InChI=1S/C27H55NO2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-28-27(29)30-26-24-22-10-8-6-4-2/h3-26H2,1-2H3,(H,28,29)

InChI Key

OEEWTACEHHRHGE-UHFFFAOYSA-N

Formula

C27H55NO2

SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCCCCCCCC

Molecular Weight¹

425.73

• 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	1.2927		Relay (1.0) Calculated Property
ΔfG°	31.93	kJ/mol	Joback Calculated Property
ΔfH°gas	-931.02	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	73.57	kJ/mol	Joback Calculated Property
ΔvapH°	139.33	kJ/mol	Relay (1.0) Calculated Property
IE	9.56	eV	Relay (1.0) Calculated Property
log10WS	-8.75		Relay (1.0) Calculated Property
logPoct/wat	9.335		Crippen Calculated Property
McVol	408.710	ml/mol	McGowan Calculated Property
Pc	710.73	kPa	Joback Calculated Property
Inp	[3132.00; 3132.00]
Inp	3132.00		NIST
Inp	3132.00		NIST
Tboil	651.00	K	Relay (1.0) Calculated Property
Tc	857.99	K	Relay (1.0) Calculated Property
Tfus	329.58	K	Relay (1.0) Calculated Property
Vc	1.597	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1421.14; 1540.17]	J/mol×K	[943.62; 1165.23]
Cp,gas	1421.14	J/mol×K	943.62	Joback Calculated Property
Cp,gas	1444.87	J/mol×K	980.55	Joback Calculated Property
Cp,gas	1466.94	J/mol×K	1017.49	Joback Calculated Property
Cp,gas	1487.43	J/mol×K	1054.42	Joback Calculated Property
Cp,gas	1506.41	J/mol×K	1091.36	Joback Calculated Property
Cp,gas	1523.97	J/mol×K	1128.29	Joback Calculated Property
Cp,gas	1540.17	J/mol×K	1165.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, monoamide, N-octadecyl-, octyl ester.

Sources

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

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