ChemSpider 2D Image | 4-Ethynylbenzenesulfonyl chloride | C8H5ClO2S

4-Ethynylbenzenesulfonyl chloride

  • Molecular FormulaC8H5ClO2S
  • Average mass200.642 Da
  • Monoisotopic mass199.969879 Da
  • ChemSpider ID75720358

More details:

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

4-Ethinylbenzolsulfonylchlorid [German] [ACD/IUPAC Name]
4-Ethynylbenzenesulfonyl chloride [ACD/IUPAC Name]
Benzenesulfonyl chloride, 4-ethynyl- [ACD/Index Name]
Chlorure de 4-éthynylbenzènesulfonyle [French] [ACD/IUPAC Name]
2168215-65-2 [RN]
4-ethynylbenzene-1-sulfonylchloride

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

Density: 1.4±0.1 g/cm3
Boiling Point: 282.0±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.0±3.0 kJ/mol
Flash Point: 124.4±22.6 °C
Index of Refraction: 1.599
Molar Refractivity: 47.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 22.67
ACD/KOC (pH 5.5): 324.96
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 22.67
ACD/KOC (pH 7.4): 324.96
Polar Surface Area: 43 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 56.0±5.0 dyne/cm
Molar Volume: 138.9±5.0 cm3

Click to predict properties on the Chemicalize site


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