ChemSpider 2D Image | 6-Chloro-2-[(methylsulfanyl)methyl]-1H-benzimidazole-5-sulfonamide | C9H10ClN3O2S2

6-Chloro-2-[(methylsulfanyl)methyl]-1H-benzimidazole-5-sulfonamide

  • Molecular FormulaC9H10ClN3O2S2
  • Average mass291.778 Da
  • Monoisotopic mass290.990295 Da
  • ChemSpider ID28704177

More details:

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

1H-Benzimidazole-5-sulfonamide, 6-chloro-2-[(methylthio)methyl]- [ACD/Index Name]
6-Chlor-2-[(methylsulfanyl)methyl]-1H-benzimidazol-5-sulfonamid [German] [ACD/IUPAC Name]
6-Chloro-2-[(methylsulfanyl)methyl]-1H-benzimidazole-5-sulfonamide [ACD/IUPAC Name]
6-Chloro-2-[(méthylsulfanyl)méthyl]-1H-benzimidazole-5-sulfonamide [French] [ACD/IUPAC Name]
5-Chloro-2-[(methylsulfanyl)methyl]-1H-benzimidazole-6-sulfonamide
89725-09-7 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 600.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.4±3.0 kJ/mol
Flash Point: 317.2±34.3 °C
Index of Refraction: 1.699
Molar Refractivity: 70.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.49
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 6.72
ACD/KOC (pH 5.5): 135.92
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.19
ACD/KOC (pH 7.4): 125.11
Polar Surface Area: 123 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 77.7±3.0 dyne/cm
Molar Volume: 182.8±3.0 cm3

Click to predict properties on the Chemicalize site


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