Chemical Properties of 3,5-dibromophenol

InChI

InChI=1S/C6H4Br2O/c7-4-1-5(8)3-6(9)2-4/h1-3,9H

InChI Key

PZFMWYNHJFZBPO-UHFFFAOYSA-N

Formula

C6H4Br2O

SMILES

Oc1cc(Br)cc(Br)c1

Molecular Weight¹

251.91

• 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).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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	[122.92; 247.87]	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			-1.47100e+01
Coefficient B			6.66400e-01
Coefficient C			-6.65920e-04
Coefficient D			2.62100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	122.92	J/mol×K	273.00	Calculated Property
Cp,gas	149.31	J/mol×K	353.78	Calculated Property
Cp,gas	170.63	J/mol×K	434.56	Calculated Property
Cp,gas	187.73	J/mol×K	515.33	Calculated Property
Cp,gas	201.42	J/mol×K	596.11	Calculated Property
Cp,gas	212.55	J/mol×K	676.89	Calculated Property
Cp,gas	221.92	J/mol×K	757.67	Calculated Property
Cp,gas	230.38	J/mol×K	838.44	Calculated Property
Cp,gas	238.75	J/mol×K	919.22	Calculated Property
Cp,gas	247.87	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007319; 0.0000548]	Pa×s	[427.64; 595.07]	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			-1.64329e+01
Coefficient B			3.93990e+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.			427.64
Temperature range, max.			595.07
η	0.0007319	Pa×s	427.64	Calculated Property
η	0.0004985	Pa×s	446.24	Calculated Property
η	0.0003501	Pa×s	464.85	Calculated Property
η	0.0002527	Pa×s	483.45	Calculated Property
η	0.0001868	Pa×s	502.05	Calculated Property
η	0.0001411	Pa×s	520.65	Calculated Property
η	0.0001087	Pa×s	539.26	Calculated Property
η	0.0000852	Pa×s	557.86	Calculated Property
η	0.0000678	Pa×s	576.46	Calculated Property
η	0.0000548	Pa×s	595.07	Calculated Property

Similar Compounds

Find more compounds similar to 3,5-dibromophenol.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Thermochemical study of three dibromophenol isomers
• Joback Method
• McGowan Method

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