ChemSpider 2D Image | 2,1,3-Benzoxadiazole-5-sulfonyl chloride 3-oxide | C6H3ClN2O4S

2,1,3-Benzoxadiazole-5-sulfonyl chloride 3-oxide

  • Molecular FormulaC6H3ClN2O4S
  • Average mass234.617 Da
  • Monoisotopic mass233.950211 Da
  • ChemSpider ID49620864

More details:

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

2,1,3-Benzoxadiazol-5-sulfonylchlorid-3-oxid [German] [ACD/IUPAC Name]
2,1,3-Benzoxadiazole-5-sulfonyl chloride 3-oxide [ACD/IUPAC Name]
2,1,3-Benzoxadiazole-5-sulfonyl chloride, 3-oxide [ACD/Index Name]
Chlorure de 3-oxyde de -2,1,3-benzoxadiazole-5-sulfonyle [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 398.9±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.4±3.0 kJ/mol
Flash Point: 195.0±25.7 °C
Index of Refraction: 1.738
Molar Refractivity: 48.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 2.77
ACD/KOC (pH 5.5): 72.15
ACD/LogD (pH 7.4): 0.88
ACD/BCF (pH 7.4): 2.77
ACD/KOC (pH 7.4): 72.20
Polar Surface Area: 94 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 82.7±7.0 dyne/cm
Molar Volume: 121.1±7.0 cm3

Click to predict properties on the Chemicalize site


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