Chemical Properties of 4-Bromo-2-phenyl phenol

InChI

InChI=1S/C12H9BrO/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,14H

InChI Key

AWIYHSVPCXSVRF-UHFFFAOYSA-N

Formula

C12H9BrO

SMILES

Oc1ccc(Br)cc1-c1ccccc1

Molecular Weight¹

249.11

Other Names

• 5-bromo[1,1'-biphenyl]-2-ol
• [1,1'-Biphenyl]-2-ol, 5-bromo-

• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[178.96; 429.82]	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			-6.22600e+01
Coefficient B			1.11930e+00
Coefficient C			-9.52120e-04
Coefficient D			3.24900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	178.96	J/mol×K	273.00	Calculated Property
Cp,gas	228.94	J/mol×K	353.78	Calculated Property
Cp,gas	271.00	J/mol×K	434.56	Calculated Property
Cp,gas	306.16	J/mol×K	515.33	Calculated Property
Cp,gas	335.46	J/mol×K	596.11	Calculated Property
Cp,gas	359.90	J/mol×K	676.89	Calculated Property
Cp,gas	380.54	J/mol×K	757.67	Calculated Property
Cp,gas	398.38	J/mol×K	838.44	Calculated Property
Cp,gas	414.47	J/mol×K	919.22	Calculated Property
Cp,gas	429.82	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0187502; 0.0000242]	Pa×s	[326.50; 667.02]	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			-1.70041e+01
Coefficient B			4.25350e+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.			326.50
Temperature range, max.			667.02
η	0.0187502	Pa×s	326.50	Calculated Property
η	0.0048468	Pa×s	364.34	Calculated Property
η	0.0016160	Pa×s	402.17	Calculated Property
η	0.0006509	Pa×s	440.01	Calculated Property
η	0.0003027	Pa×s	477.84	Calculated Property
η	0.0001576	Pa×s	515.68	Calculated Property
η	0.0000897	Pa×s	553.51	Calculated Property
η	0.0000548	Pa×s	591.35	Calculated Property
η	0.0000356	Pa×s	629.19	Calculated Property
η	0.0000242	Pa×s	667.02	Calculated Property

Similar Compounds

Find more compounds similar to 4-Bromo-2-phenyl phenol.

Sources

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

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