ChemSpider 2D Image | 2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]ethanesulfonyl chloride | C6H8ClN3O4S2

2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]ethanesulfonyl chloride

  • Molecular FormulaC6H8ClN3O4S2
  • Average mass285.728 Da
  • Monoisotopic mass284.964478 Da
  • ChemSpider ID44675117

More details:

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

2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]ethanesulfonyl chloride [ACD/IUPAC Name]
2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]ethansulfonylchlorid [German] [ACD/IUPAC Name]
Chlorure de 2-[(1-méthyl-4-nitro-1H-imidazol-5-yl)sulfanyl]éthanesulfonyle [French] [ACD/IUPAC Name]
Ethanesulfonyl chloride, 2-[(1-methyl-4-nitro-1H-imidazol-5-yl)thio]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 499.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 255.6±27.3 °C
Index of Refraction: 1.680
Molar Refractivity: 62.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.75
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 2.04
ACD/KOC (pH 5.5): 57.89
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 2.04
ACD/KOC (pH 7.4): 57.89
Polar Surface Area: 131 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 73.4±7.0 dyne/cm
Molar Volume: 164.9±7.0 cm3

Click to predict properties on the Chemicalize site


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