Chemical Properties of Sebacic acid, decyl 3-phenylpropyl ester

InChI

InChI=1S/C29H48O4/c1-2-3-4-5-6-9-12-18-25-32-28(30)23-16-10-7-8-11-17-24-29(31)33-26-19-22-27-20-14-13-15-21-27/h13-15,20-21H,2-12,16-19,22-26H2,1H3

InChI Key

JGISYYPXSOXOGU-UHFFFAOYSA-N

Formula

C29H48O4

SMILES

CCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCc1ccccc1

Molecular Weight¹

460.70

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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[596.10; 1413.16]	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			-6.56000e+00
Coefficient B			2.57032e+00
Coefficient C			-1.39580e-03
Coefficient D			2.45200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	596.10	J/mol×K	273.00	Calculated Property
Cp,gas	738.92	J/mol×K	353.78	Calculated Property
Cp,gas	866.93	J/mol×K	434.56	Calculated Property
Cp,gas	980.89	J/mol×K	515.33	Calculated Property
Cp,gas	1081.58	J/mol×K	596.11	Calculated Property
Cp,gas	1169.78	J/mol×K	676.89	Calculated Property
Cp,gas	1246.26	J/mol×K	757.67	Calculated Property
Cp,gas	1311.80	J/mol×K	838.44	Calculated Property
Cp,gas	1367.18	J/mol×K	919.22	Calculated Property
Cp,gas	1413.16	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003373; 0.0000194]	Pa×s	[527.67; 866.30]	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			-1.52983e+01
Coefficient B			3.85394e+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.			527.67
Temperature range, max.			866.30
η	0.0003373	Pa×s	527.67	Calculated Property
η	0.0002074	Pa×s	565.30	Calculated Property
η	0.0001356	Pa×s	602.92	Calculated Property
η	0.0000931	Pa×s	640.55	Calculated Property
η	0.0000667	Pa×s	678.17	Calculated Property
η	0.0000495	Pa×s	715.80	Calculated Property
η	0.0000378	Pa×s	753.43	Calculated Property
η	0.0000296	Pa×s	791.05	Calculated Property
η	0.0000238	Pa×s	828.68	Calculated Property
η	0.0000194	Pa×s	866.30	Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, decyl 3-phenylpropyl ester.

Sources

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

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