Chemical Properties of Sebacic acid, di(2-ethylphenyl) ester

InChI

InChI=1S/C26H34O4/c1-3-21-15-11-13-17-23(21)29-25(27)19-9-7-5-6-8-10-20-26(28)30-24-18-14-12-16-22(24)4-2/h11-18H,3-10,19-20H2,1-2H3

InChI Key

QSXDLJXFRCBEDV-UHFFFAOYSA-N

Formula

C26H34O4

SMILES

CCc1ccccc1OC(=O)CCCCCCCCC(=O)Oc1ccccc1CC

Molecular Weight¹

410.55

• 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	[480.30; 1133.78]	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			-9.14000e+00
Coefficient B			2.08744e+00
Coefficient C			-1.12972e-03
Coefficient D			1.85200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	480.30	J/mol×K	273.00	Calculated Property
Cp,gas	596.16	J/mol×K	353.78	Calculated Property
Cp,gas	699.83	J/mol×K	434.56	Calculated Property
Cp,gas	791.92	J/mol×K	515.33	Calculated Property
Cp,gas	872.99	J/mol×K	596.11	Calculated Property
Cp,gas	943.65	J/mol×K	676.89	Calculated Property
Cp,gas	1004.47	J/mol×K	757.67	Calculated Property
Cp,gas	1056.04	J/mol×K	838.44	Calculated Property
Cp,gas	1098.95	J/mol×K	919.22	Calculated Property
Cp,gas	1133.78	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003066; 0.0000327]	Pa×s	[545.32; 837.12]	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			-1.45125e+01
Coefficient B			3.50236e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			545.32
Temperature range, max.			837.12
η	0.0003066	Pa×s	545.32	Calculated Property
η	0.0002138	Pa×s	577.74	Calculated Property
η	0.0001549	Pa×s	610.16	Calculated Property
η	0.0001160	Pa×s	642.59	Calculated Property
η	0.0000893	Pa×s	675.01	Calculated Property
η	0.0000704	Pa×s	707.43	Calculated Property
η	0.0000566	Pa×s	739.85	Calculated Property
η	0.0000464	Pa×s	772.27	Calculated Property
η	0.0000387	Pa×s	804.70	Calculated Property
η	0.0000327	Pa×s	837.12	Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, di(2-ethylphenyl) ester.

Sources

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

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