Chemical Properties of Glutaric acid, 2-biphenyl hexyl ester

InChI

InChI=1S/C23H28O4/c1-2-3-4-10-18-26-22(24)16-11-17-23(25)27-21-15-9-8-14-20(21)19-12-6-5-7-13-19/h5-9,12-15H,2-4,10-11,16-18H2,1H3

InChI Key

SZXMBKJMQWMLIE-UHFFFAOYSA-N

Formula

C23H28O4

SMILES

CCCCCCOC(=O)CCCC(=O)Oc1ccccc1-c1ccccc1

Molecular Weight¹

368.47

• 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	[414.11; 982.05]	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			-2.07120e+01
Coefficient B			1.86192e+00
Coefficient C			-1.03356e-03
Coefficient D			1.74400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	414.11	J/mol×K	273.00	Calculated Property
Cp,gas	516.36	J/mol×K	353.78	Calculated Property
Cp,gas	607.53	J/mol×K	434.56	Calculated Property
Cp,gas	688.18	J/mol×K	515.33	Calculated Property
Cp,gas	758.87	J/mol×K	596.11	Calculated Property
Cp,gas	820.13	J/mol×K	676.89	Calculated Property
Cp,gas	872.53	J/mol×K	757.67	Calculated Property
Cp,gas	916.62	J/mol×K	838.44	Calculated Property
Cp,gas	952.94	J/mol×K	919.22	Calculated Property
Cp,gas	982.05	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0005198; 0.0000484]	Pa×s	[498.99; 782.25]	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			-1.41176e+01
Coefficient B			3.27114e+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.			498.99
Temperature range, max.			782.25
η	0.0005198	Pa×s	498.99	Calculated Property
η	0.0003523	Pa×s	530.46	Calculated Property
η	0.0002494	Pa×s	561.94	Calculated Property
η	0.0001832	Pa×s	593.41	Calculated Property
η	0.0001388	Pa×s	624.88	Calculated Property
η	0.0001080	Pa×s	656.35	Calculated Property
η	0.0000859	Pa×s	687.83	Calculated Property
η	0.0000698	Pa×s	719.30	Calculated Property
η	0.0000577	Pa×s	750.77	Calculated Property
η	0.0000484	Pa×s	782.25	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-biphenyl hexyl ester.

Sources

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

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