Chemical Properties of 4'-Ethyl-4-biphenylcarboxylic acid (CAS 5731-13-5)

InChI

InChI=1S/C15H14O2/c1-2-11-3-5-12(6-4-11)13-7-9-14(10-8-13)15(16)17/h3-10H,2H2,1H3,(H,16,17)

InChI Key

SCEBDBNGUCNRCE-UHFFFAOYSA-N

Formula

C15H14O2

SMILES

CCc1ccc(-c2ccc(C(=O)O)cc2)cc1

Molecular Weight¹

226.27

CAS

5731-13-5

Other Names

• 4-(4-Ethylphenyl)benzoic acid
• 4-Ethylbiphenyl-4'-carboxylic acid

• 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).
• 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	[227.90; 560.84]	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			-4.53590e+01
Coefficient B			1.20282e+00
Coefficient C			-7.93120e-04
Coefficient D			1.96500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	227.90	J/mol×K	273.00	Calculated Property
Cp,gas	289.61	J/mol×K	353.78	Calculated Property
Cp,gas	343.69	J/mol×K	434.56	Calculated Property
Cp,gas	390.76	J/mol×K	515.33	Calculated Property
Cp,gas	431.45	J/mol×K	596.11	Calculated Property
Cp,gas	466.37	J/mol×K	676.89	Calculated Property
Cp,gas	496.15	J/mol×K	757.67	Calculated Property
Cp,gas	521.40	J/mol×K	838.44	Calculated Property
Cp,gas	542.76	J/mol×K	919.22	Calculated Property
Cp,gas	560.84	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006720; 0.0001637]	Pa×s	[497.29; 696.41]	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			-1.22442e+01
Coefficient B			2.45610e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			497.29
Temperature range, max.			696.41
η	0.0006720	Pa×s	497.29	Calculated Property
η	0.0005445	Pa×s	519.41	Calculated Property
η	0.0004488	Pa×s	541.54	Calculated Property
η	0.0003756	Pa×s	563.66	Calculated Property
η	0.0003186	Pa×s	585.79	Calculated Property
η	0.0002735	Pa×s	607.91	Calculated Property
η	0.0002374	Pa×s	630.04	Calculated Property
η	0.0002080	Pa×s	652.16	Calculated Property
η	0.0001838	Pa×s	674.29	Calculated Property
η	0.0001637	Pa×s	696.41	Calculated Property

Similar Compounds

Find more compounds similar to 4'-Ethyl-4-biphenylcarboxylic acid.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.