ChemSpider 2D Image | 1,3-Benzothiazole-4-sulfonamide | C7H6N2O2S2

1,3-Benzothiazole-4-sulfonamide

  • Molecular FormulaC7H6N2O2S2
  • Average mass214.265 Da
  • Monoisotopic mass213.987061 Da
  • ChemSpider ID58122683

More details:

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

1,3-Benzothiazol-4-sulfonamid [German] [ACD/IUPAC Name]
1,3-Benzothiazole-4-sulfonamide [ACD/IUPAC Name]
1,3-Benzothiazole-4-sulfonamide [French] [ACD/IUPAC Name]
4-Benzothiazolesulfonamide [ACD/Index Name]
2122108-82-9 [RN]
Benzothiazole-4-sulfonic acid amide
MFCD30188297

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

Density: 1.6±0.1 g/cm3
Boiling Point: 444.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.4±26.5 °C
Index of Refraction: 1.708
Molar Refractivity: 52.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.24
ACD/KOC (pH 5.5): 40.58
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.23
ACD/KOC (pH 7.4): 40.35
Polar Surface Area: 110 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 75.3±3.0 dyne/cm
Molar Volume: 135.2±3.0 cm3

Click to predict properties on the Chemicalize site


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