Chemical Properties of Dibenzodioxin, 1,2,6-tribromo-, 4,8-dichloro-

InChI

InChI=1S/C12H3Br3Cl2O2/c13-5-3-7(17)11-12(9(5)15)18-8-2-4(16)1-6(14)10(8)19-11/h1-3H

InChI Key

KRYWARCUPZJWJI-UHFFFAOYSA-N

Formula

C12H3Br3Cl2O2

SMILES

Clc1cc(Br)c2c(c1)Oc1c(Br)c(Br)cc(Cl)c1O2

Molecular Weight¹

489.77

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• 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 formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[419.58; 463.77]	J/mol×K	[896.56; 1187.57]
Cp,gas	419.58	J/mol×K	896.56	Joback Calculated Property
Cp,gas	426.45	J/mol×K	945.06	Joback Calculated Property
Cp,gas	433.27	J/mol×K	993.56	Joback Calculated Property
Cp,gas	440.23	J/mol×K	1042.06	Joback Calculated Property
Cp,gas	447.51	J/mol×K	1090.57	Joback Calculated Property
Cp,gas	455.30	J/mol×K	1139.07	Joback Calculated Property
Cp,gas	463.77	J/mol×K	1187.57	Joback Calculated Property
η	[0.0003460; 0.0007743]	Pa×s	[683.56; 896.56]
η	0.0007743	Pa×s	683.56	Joback Calculated Property
η	0.0006549	Pa×s	719.06	Joback Calculated Property
η	0.0005628	Pa×s	754.56	Joback Calculated Property
η	0.0004902	Pa×s	790.06	Joback Calculated Property
η	0.0004321	Pa×s	825.56	Joback Calculated Property
η	0.0003849	Pa×s	861.06	Joback Calculated Property
η	0.0003460	Pa×s	896.56	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dibenzodioxin, 1,2,6-tribromo-, 4,8-dichloro-.

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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