Chemical Properties of Glutaric acid, monoamide, N-(2-octyl)-, heptyl ester

InChI

InChI=1S/C20H39NO3/c1-4-6-8-10-12-17-24-20(23)16-13-15-19(22)21-18(3)14-11-9-7-5-2/h18H,4-17H2,1-3H3,(H,21,22)

InChI Key

XIZLAUNXFHGULO-UHFFFAOYSA-N

Formula

C20H39NO3

SMILES

CCCCCCCOC(=O)CCCC(=O)NC(C)CCCCCC

Molecular Weight¹

341.53

• 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°	-158.37	kJ/mol	Joback Calculated Property
ΔfH°gas	-765.32	kJ/mol	Joback Calculated Property
ΔfusH°	53.52	kJ/mol	Joback Calculated Property
ΔvapH°	82.06	kJ/mol	Joback Calculated Property
log10WS	-6.13		Crippen Calculated Property
logPoct/wat	5.145		Crippen Calculated Property
McVol	311.650	ml/mol	McGowan Calculated Property
Pc	1105.21	kPa	Joback Calculated Property
Inp	[2857.00; 2857.00]
Inp	2857.00		NIST
Inp	2857.00		NIST
Tboil	836.89	K	Joback Calculated Property
Tc	1026.30	K	Joback Calculated Property
Tfus	474.91	K	Joback Calculated Property
Vc	1.214	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1002.70; 1095.92]	J/mol×K	[836.89; 1026.30]
Cp,gas	1002.70	J/mol×K	836.89	Joback Calculated Property
Cp,gas	1020.82	J/mol×K	868.46	Joback Calculated Property
Cp,gas	1037.87	J/mol×K	900.03	Joback Calculated Property
Cp,gas	1053.88	J/mol×K	931.59	Joback Calculated Property
Cp,gas	1068.87	J/mol×K	963.16	Joback Calculated Property
Cp,gas	1082.87	J/mol×K	994.73	Joback Calculated Property
Cp,gas	1095.92	J/mol×K	1026.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, monoamide, N-(2-octyl)-, heptyl ester.

Sources

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

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