ChemSpider 2D Image | 3-Methyl-2,6-dinitrobenzenesulfonyl chloride | C7H5ClN2O6S

3-Methyl-2,6-dinitrobenzenesulfonyl chloride

  • Molecular FormulaC7H5ClN2O6S
  • Average mass280.642 Da
  • Monoisotopic mass279.955688 Da
  • ChemSpider ID61946667

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-Methyl-2,6-dinitrobenzenesulfonyl chloride [ACD/IUPAC Name]
3-Methyl-2,6-dinitrobenzolsulfonylchlorid [German] [ACD/IUPAC Name]
Benzenesulfonyl chloride, 3-methyl-2,6-dinitro- [ACD/Index Name]
Chlorure de 3-méthyl-2,6-dinitrobenzènesulfonyle [French] [ACD/IUPAC Name]
2092343-28-5 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point: 442.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 221.2±28.7 °C
Index of Refraction: 1.604
Molar Refractivity: 57.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.42
ACD/KOC (pH 5.5): 391.60
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.42
ACD/KOC (pH 7.4): 391.60
Polar Surface Area: 134 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 66.7±3.0 dyne/cm
Molar Volume: 166.0±3.0 cm3

Click to predict properties on the Chemicalize site


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