Chemical Properties of Glutaric acid, monoamide, N-(2-biphenyl)-, isohexyl ester

InChI

InChI=1S/C23H29NO3/c1-18(2)10-9-17-27-23(26)16-8-15-22(25)24-21-14-7-6-13-20(21)19-11-4-3-5-12-19/h3-7,11-14,18H,8-10,15-17H2,1-2H3,(H,24,25)

InChI Key

AKYINDIHZAKQLM-UHFFFAOYSA-N

Formula

C23H29NO3

SMILES

CC(C)CCCOC(=O)CCCC(=O)Nc1ccccc1-c1ccccc1

Molecular Weight¹

367.48

• 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	0.9511		Relay (1.0) Calculated Property
ΔfG°	82.08	kJ/mol	Joback Calculated Property
ΔfH°gas	-535.78	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	48.98	kJ/mol	Joback Calculated Property
ΔvapH°	119.99	kJ/mol	Relay (1.0) Calculated Property
IE	8.04	eV	Relay (1.0) Calculated Property
log10WS	-5.10		Relay (1.0) Calculated Property
logPoct/wat	5.442		Crippen Calculated Property
McVol	306.400	ml/mol	McGowan Calculated Property
Pc	1425.07	kPa	Joback Calculated Property
Inp	[2938.00; 2938.00]
Inp	2938.00		NIST
Inp	2938.00		NIST
Tboil	704.30	K	Relay (1.0) Calculated Property
Tc	961.34	K	Relay (1.0) Calculated Property
Tfus	370.02	K	Relay (1.0) Calculated Property
Vc	1.097	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[986.22; 1053.55]	J/mol×K	[963.87; 1190.70]
Cp,gas	986.22	J/mol×K	963.87	Joback Calculated Property
Cp,gas	1000.40	J/mol×K	1001.68	Joback Calculated Property
Cp,gas	1013.29	J/mol×K	1039.48	Joback Calculated Property
Cp,gas	1024.99	J/mol×K	1077.29	Joback Calculated Property
Cp,gas	1035.54	J/mol×K	1115.09	Joback Calculated Property
Cp,gas	1045.04	J/mol×K	1152.90	Joback Calculated Property
Cp,gas	1053.55	J/mol×K	1190.70	Joback Calculated Property

Similar Compounds

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

Sources

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

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