ChemSpider 2D Image | 1,3-Benzothiazol-2-yl sulfamate | C7H6N2O3S2

1,3-Benzothiazol-2-yl sulfamate

  • Molecular FormulaC7H6N2O3S2
  • Average mass230.264 Da
  • Monoisotopic mass229.981979 Da
  • ChemSpider ID65489406

More details:

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

1,3-Benzothiazol-2-yl sulfamate [ACD/IUPAC Name]
1,3-Benzothiazol-2-ylsulfamat [German] [ACD/IUPAC Name]
Sulfamate de 1,3-benzothiazol-2-yle [French] [ACD/IUPAC Name]
Sulfamic acid, 2-benzothiazolyl ester [ACD/Index Name]
2229574-16-5 [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: 424.1±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 210.3±24.0 °C
Index of Refraction: 1.716
Molar Refractivity: 54.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 1.16
ACD/BCF (pH 5.5): 4.47
ACD/KOC (pH 5.5): 100.93
ACD/LogD (pH 7.4): 0.72
ACD/BCF (pH 7.4): 1.61
ACD/KOC (pH 7.4): 36.46
Polar Surface Area: 119 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 82.7±3.0 dyne/cm
Molar Volume: 138.5±3.0 cm3

Click to predict properties on the Chemicalize site


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