Chemical Properties of Succinic acid, 4-biphenyl tridecyl ester

InChI

InChI=1S/C29H40O4/c1-2-3-4-5-6-7-8-9-10-11-15-24-32-28(30)22-23-29(31)33-27-20-18-26(19-21-27)25-16-13-12-14-17-25/h12-14,16-21H,2-11,15,22-24H2,1H3

InChI Key

UFPFJRJSOGBSQA-UHFFFAOYSA-N

Formula

C29H40O4

SMILES

CCCCCCCCCCCCCOC(=O)CCC(=O)Oc1ccc(-c2ccccc2)cc1

Molecular Weight¹

452.63

• 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).
• 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, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[541.39; 1291.59]	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			-2.61660e+01
Coefficient B			2.43192e+00
Coefficient C			-1.35996e-03
Coefficient D			2.45800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	541.39	J/mol×K	273.00	Calculated Property
Cp,gas	674.87	J/mol×K	353.78	Calculated Property
Cp,gas	794.00	J/mol×K	434.56	Calculated Property
Cp,gas	899.56	J/mol×K	515.33	Calculated Property
Cp,gas	992.34	J/mol×K	596.11	Calculated Property
Cp,gas	1073.10	J/mol×K	676.89	Calculated Property
Cp,gas	1142.63	J/mol×K	757.67	Calculated Property
Cp,gas	1201.71	J/mol×K	838.44	Calculated Property
Cp,gas	1251.10	J/mol×K	919.22	Calculated Property
Cp,gas	1291.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0002398; 0.0000205]	Pa×s	[566.61; 889.57]	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			-1.51059e+01
Coefficient B			3.83610e+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.			566.61
Temperature range, max.			889.57
η	0.0002398	Pa×s	566.61	Calculated Property
η	0.0001602	Pa×s	602.49	Calculated Property
η	0.0001120	Pa×s	638.38	Calculated Property
η	0.0000814	Pa×s	674.26	Calculated Property
η	0.0000610	Pa×s	710.15	Calculated Property
η	0.0000471	Pa×s	746.03	Calculated Property
η	0.0000372	Pa×s	781.91	Calculated Property
η	0.0000300	Pa×s	817.80	Calculated Property
η	0.0000246	Pa×s	853.68	Calculated Property
η	0.0000205	Pa×s	889.57	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 4-biphenyl tridecyl ester.

Sources

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

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