Chemical Properties of Dodecanoic acid, 4-biphenyl ester

InChI

InChI=1S/C24H32O2/c1-2-3-4-5-6-7-8-9-13-16-24(25)26-23-19-17-22(18-20-23)21-14-11-10-12-15-21/h10-12,14-15,17-20H,2-9,13,16H2,1H3

InChI Key

LCRGZXAZWAIIGQ-UHFFFAOYSA-N

Formula

C24H32O2

SMILES

CCCCCCCCCCCC(=O)Oc1ccc(-c2ccccc2)cc1

Molecular Weight¹

352.51

• 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	[418.99; 1025.53]	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			-4.70300e+01
Coefficient B			2.01172e+00
Coefficient C			-1.18256e-03
Coefficient D			2.43400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	418.99	J/mol×K	273.00	Calculated Property
Cp,gas	527.44	J/mol×K	353.78	Calculated Property
Cp,gas	623.83	J/mol×K	434.56	Calculated Property
Cp,gas	708.94	J/mol×K	515.33	Calculated Property
Cp,gas	783.52	J/mol×K	596.11	Calculated Property
Cp,gas	848.34	J/mol×K	676.89	Calculated Property
Cp,gas	904.19	J/mol×K	757.67	Calculated Property
Cp,gas	951.82	J/mol×K	838.44	Calculated Property
Cp,gas	992.01	J/mol×K	919.22	Calculated Property
Cp,gas	1025.53	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007210; 0.0000647]	Pa×s	[467.93; 753.66]	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			-1.35939e+01
Coefficient B			2.97558e+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.			467.93
Temperature range, max.			753.66
η	0.0007210	Pa×s	467.93	Calculated Property
η	0.0004814	Pa×s	499.68	Calculated Property
η	0.0003373	Pa×s	531.43	Calculated Property
η	0.0002460	Pa×s	563.17	Calculated Property
η	0.0001855	Pa×s	594.92	Calculated Property
η	0.0001440	Pa×s	626.67	Calculated Property
η	0.0001145	Pa×s	658.42	Calculated Property
η	0.0000930	Pa×s	690.16	Calculated Property
η	0.0000770	Pa×s	721.91	Calculated Property
η	0.0000647	Pa×s	753.66	Calculated Property

Similar Compounds

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

Sources

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

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