Chemical Properties of 3,4,5,6-tetrachlorobenzene-1,2-diol

InChI

InChI=1S/C6H2Cl4O2/c7-1-2(8)4(10)6(12)5(11)3(1)9/h11-12H

InChI Key

RRBMVWQICIXSEO-UHFFFAOYSA-N

Formula

C6H2Cl4O2

SMILES

Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl

Molecular Weight¹

247.89

• 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_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	[170.55; 279.15]	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			4.01500e+01
Coefficient B			6.52800e-01
Coefficient C			-7.27000e-04
Coefficient D			3.13200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	170.55	J/mol×K	273.00	Calculated Property
Cp,gas	193.97	J/mol×K	353.78	Calculated Property
Cp,gas	212.24	J/mol×K	434.56	Calculated Property
Cp,gas	226.35	J/mol×K	515.33	Calculated Property
Cp,gas	237.30	J/mol×K	596.11	Calculated Property
Cp,gas	246.06	J/mol×K	676.89	Calculated Property
Cp,gas	253.64	J/mol×K	757.67	Calculated Property
Cp,gas	261.02	J/mol×K	838.44	Calculated Property
Cp,gas	269.19	J/mol×K	919.22	Calculated Property
Cp,gas	279.15	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000238; 0.0000040]	Pa×s	[564.48; 667.77]	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			-2.21010e+01
Coefficient B			6.46588e+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.			564.48
Temperature range, max.			667.77
η	0.0000238	Pa×s	564.48	Calculated Property
η	0.0000189	Pa×s	575.96	Calculated Property
η	0.0000152	Pa×s	587.43	Calculated Property
η	0.0000123	Pa×s	598.91	Calculated Property
η	0.0000101	Pa×s	610.38	Calculated Property
η	0.0000083	Pa×s	621.86	Calculated Property
η	0.0000068	Pa×s	633.34	Calculated Property
η	0.0000057	Pa×s	644.81	Calculated Property
η	0.0000048	Pa×s	656.29	Calculated Property
η	0.0000040	Pa×s	667.77	Calculated Property

Similar Compounds

Find more compounds similar to 3,4,5,6-tetrachlorobenzene-1,2-diol.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method

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