Chemical Properties of Glutaric acid, monoamide, N-(2-phenylpropyl)-, decyl ester

InChI

InChI=1S/C24H39NO3/c1-3-4-5-6-7-8-9-13-19-28-24(27)18-14-17-23(26)25-20-21(2)22-15-11-10-12-16-22/h10-12,15-16,21H,3-9,13-14,17-20H2,1-2H3,(H,25,26)

InChI Key

CWYANFVJUDVLRC-UHFFFAOYSA-N

Formula

C24H39NO3

SMILES

CCCCCCCCCCOC(=O)CCCC(=O)NCC(C)c1ccccc1

Molecular Weight¹

389.58

• ω : Acentric Factor.
• 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).
• 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	1.0613		Relay (1.0) Calculated Property
ΔfH°gas	-760.28	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	59.50	kJ/mol	Joback Calculated Property
ΔvapH°	122.05	kJ/mol	Relay (1.0) Calculated Property
IE	8.75	eV	Relay (1.0) Calculated Property
log10WS	-5.47		Relay (1.0) Calculated Property
logPoct/wat	5.760		Crippen Calculated Property
McVol	344.250	ml/mol	McGowan Calculated Property
Pc	1039.24	kPa	Joback Calculated Property
Inp	[3044.00; 3044.00]
Inp	3044.00		NIST
Inp	3044.00		NIST
Tboil	669.49	K	Relay (1.0) Calculated Property
Tc	896.69	K	Relay (1.0) Calculated Property
Tfus	319.69	K	Relay (1.0) Calculated Property
Vc	1.264	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1144.28; 1226.97]	J/mol×K	[937.22; 1148.06]
Cp,gas	1144.28	J/mol×K	937.22	Joback Calculated Property
Cp,gas	1161.19	J/mol×K	972.36	Joback Calculated Property
Cp,gas	1176.76	J/mol×K	1007.50	Joback Calculated Property
Cp,gas	1191.06	J/mol×K	1042.64	Joback Calculated Property
Cp,gas	1204.15	J/mol×K	1077.78	Joback Calculated Property
Cp,gas	1216.10	J/mol×K	1112.92	Joback Calculated Property
Cp,gas	1226.97	J/mol×K	1148.06	Joback Calculated Property

Similar Compounds

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

Sources

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

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