Chemical Properties of Sebacic acid, 2-ethoxyethyl nonyl ester

InChI

InChI=1S/C23H44O5/c1-3-5-6-7-10-13-16-19-27-22(24)17-14-11-8-9-12-15-18-23(25)28-21-20-26-4-2/h3-21H2,1-2H3

InChI Key

YBZFHKIESIXWGV-UHFFFAOYSA-N

Formula

C23H44O5

SMILES

CCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCOCC

Molecular Weight¹

400.60

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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

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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[541.48; 1240.64]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			5.82990e+01
Coefficient B			2.01604e+00
Coefficient C			-9.27200e-04
Coefficient D			9.35000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	541.48	J/mol×K	273.00	Calculated Property
Cp,gas	659.62	J/mol×K	353.78	Calculated Property
Cp,gas	766.96	J/mol×K	434.56	Calculated Property
Cp,gas	863.79	J/mol×K	515.33	Calculated Property
Cp,gas	950.41	J/mol×K	596.11	Calculated Property
Cp,gas	1027.11	J/mol×K	676.89	Calculated Property
Cp,gas	1094.19	J/mol×K	757.67	Calculated Property
Cp,gas	1151.94	J/mol×K	838.44	Calculated Property
Cp,gas	1200.65	J/mol×K	919.22	Calculated Property
Cp,gas	1240.64	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006512; 0.0000375]	Pa×s	[455.86; 741.33]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.47460e+01
Coefficient B			3.37765e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			455.86
Temperature range, max.			741.33
η	0.0006512	Pa×s	455.86	Calculated Property
η	0.0004022	Pa×s	487.58	Calculated Property
η	0.0002634	Pa×s	519.30	Calculated Property
η	0.0001811	Pa×s	551.02	Calculated Property
η	0.0001298	Pa×s	582.74	Calculated Property
η	0.0000962	Pa×s	614.46	Calculated Property
η	0.0000735	Pa×s	646.17	Calculated Property
η	0.0000575	Pa×s	677.89	Calculated Property
η	0.0000460	Pa×s	709.61	Calculated Property
η	0.0000375	Pa×s	741.33	Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, 2-ethoxyethyl nonyl ester.

Sources

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

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