Chemical Properties of 2,3,4,6-Tetrabromophenol

InChI

InChI=1S/C6H2Br4O/c7-2-1-3(8)6(11)5(10)4(2)9/h1,11H

InChI Key

CXPJZISGVIVNEL-UHFFFAOYSA-N

Formula

C6H2Br4O

SMILES

Oc1c(Br)cc(Br)c(Br)c1Br

Molecular Weight¹

409.70

• 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).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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	[155.99; 259.93]	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			3.02700e+01
Coefficient B			6.23800e-01
Coefficient C			-6.74640e-04
Coefficient D			2.80500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	155.99	J/mol×K	273.00	Calculated Property
Cp,gas	178.94	J/mol×K	353.78	Calculated Property
Cp,gas	196.97	J/mol×K	434.56	Calculated Property
Cp,gas	210.96	J/mol×K	515.33	Calculated Property
Cp,gas	221.81	J/mol×K	596.11	Calculated Property
Cp,gas	230.40	J/mol×K	676.89	Calculated Property
Cp,gas	237.62	J/mol×K	757.67	Calculated Property
Cp,gas	244.36	J/mol×K	838.44	Calculated Property
Cp,gas	251.50	J/mol×K	919.22	Calculated Property
Cp,gas	259.93	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001123; 0.0000246]	Pa×s	[572.28; 712.77]	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			-1.67946e+01
Coefficient B			4.40694e+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.			572.28
Temperature range, max.			712.77
η	0.0001123	Pa×s	572.28	Calculated Property
η	0.0000916	Pa×s	587.89	Calculated Property
η	0.0000754	Pa×s	603.50	Calculated Property
η	0.0000627	Pa×s	619.11	Calculated Property
η	0.0000527	Pa×s	634.72	Calculated Property
η	0.0000446	Pa×s	650.33	Calculated Property
η	0.0000380	Pa×s	665.94	Calculated Property
η	0.0000327	Pa×s	681.55	Calculated Property
η	0.0000283	Pa×s	697.16	Calculated Property
η	0.0000246	Pa×s	712.77	Calculated Property

Similar Compounds

Find more compounds similar to 2,3,4,6-Tetrabromophenol.

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
• Joback Method
• McGowan Method
• NIST Webbook

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