Chemical Properties of Benzenesulfonyl chloride, 3,4-dichloro-

InChI

InChI=1S/C6H3Cl3O2S/c7-5-2-1-4(3-6(5)8)12(9,10)11/h1-3H

InChI Key

NYIBPWGZGSXURD-UHFFFAOYSA-N

Formula

C6H3Cl3O2S

SMILES

O=S(=O)(Cl)c1ccc(Cl)c(Cl)c1

Molecular Weight¹

245.51

Other Names

• 3,4-Dichlorobenzenesulfonyl chloride
• 3,4-Dichlorophenylsulfonyl chloride
• 3,4-dichlorobenzenesulphonyl chloride

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[237.77; 278.23]	J/mol×K	[533.59; 763.19]
Cp,gas	237.77	J/mol×K	533.59	Joback Calculated Property
Cp,gas	245.95	J/mol×K	571.86	Joback Calculated Property
Cp,gas	253.55	J/mol×K	610.12	Joback Calculated Property
Cp,gas	260.58	J/mol×K	648.39	Joback Calculated Property
Cp,gas	267.04	J/mol×K	686.66	Joback Calculated Property
Cp,gas	272.92	J/mol×K	724.92	Joback Calculated Property
Cp,gas	278.23	J/mol×K	763.19	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzenesulfonyl chloride, 3,4-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

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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