Chemical Properties of Endosulfan sulfate (CAS 1031-07-8)

InChI

InChI=1S/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2

InChI Key

AAPVQEMYVNZIOO-UHFFFAOYSA-N

Formula

C9H6Cl6O4S

SMILES

O=S1(=O)OCC2C(CO1)C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl

Molecular Weight¹

422.93

CAS

1031-07-8

Other Names

• 6,9-Methano-2,4,3-benzodioxathiepin, 6,7,8,9,10,10-hexachloro-1,5,5a,6,9,9a-hexahydro-, 3,3-dioxide
• 5-Norbornene-2,3-dimethanol, 1,4,5,6,7,7-hexachloro-, cyclic sulfate
• Thiodan sulfate
• Endosulfan sulphate
• 6,7,8,9,10,10-Hexachloro-1,5,5a,6,9,9a-hexahydro- 6,9-methano-2,4,3-benzodioxathiepin-3,3-dioxide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[267.98; 583.76]	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			-1.25650e+02
Coefficient B			2.01881e+00
Coefficient C			-2.41530e-03
Coefficient D			1.10590e-06
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	267.98	J/mol×K	273.00	Calculated Property
Cp,gas	335.23	J/mol×K	353.78	Calculated Property
Cp,gas	386.28	J/mol×K	434.56	Calculated Property
Cp,gas	424.63	J/mol×K	515.33	Calculated Property
Cp,gas	453.77	J/mol×K	596.11	Calculated Property
Cp,gas	477.20	J/mol×K	676.89	Calculated Property
Cp,gas	498.42	J/mol×K	757.67	Calculated Property
Cp,gas	520.92	J/mol×K	838.44	Calculated Property
Cp,gas	548.20	J/mol×K	919.22	Calculated Property
Cp,gas	583.76	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Endosulfan sulfate.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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