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

InChI

InChI=1S/C23H29NO3/c1-2-3-4-10-18-27-23(26)17-11-16-22(25)24-21-15-9-8-14-20(21)19-12-6-5-7-13-19/h5-9,12-15H,2-4,10-11,16-18H2,1H3,(H,24,25)

InChI Key

UNVWLBKYGVSSHX-UHFFFAOYSA-N

Formula

C23H29NO3

SMILES

CCCCCCOC(=O)CCCC(=O)Nc1ccccc1-c1ccccc1

Molecular Weight¹

367.48

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-516.52	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	54.09	kJ/mol	Joback Calculated Property
ΔvapH°	122.34	kJ/mol	Relay (1.0) Calculated Property
log10WS	-5.23		Relay (1.0) Calculated Property
logPoct/wat	5.586		Crippen Calculated Property
McVol	306.400	ml/mol	McGowan Calculated Property
Pc	1373.78	kPa	Joback Calculated Property
Inp	[2987.00; 2987.00]
Inp	2987.00		NIST
Inp	2987.00		NIST
Tboil	704.75	K	Relay (1.0) Calculated Property
Tfus	352.04	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[979.87; 1046.62]	J/mol×K	[946.44; 1169.02]
Cp,gas	979.87	J/mol×K	946.44	Joback Calculated Property
Cp,gas	994.00	J/mol×K	983.54	Joback Calculated Property
Cp,gas	1006.83	J/mol×K	1020.63	Joback Calculated Property
Cp,gas	1018.43	J/mol×K	1057.73	Joback Calculated Property
Cp,gas	1028.89	J/mol×K	1094.83	Joback Calculated Property
Cp,gas	1038.26	J/mol×K	1131.93	Joback Calculated Property
Cp,gas	1046.62	J/mol×K	1169.02	Joback Calculated Property

Similar Compounds

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

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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