ChemSpider 2D Image | Methyl 1-(dimethylsulfamoyl)-2-(methylamino)-6-nitro-1H-benzimidazole-5-carboxylate | C12H15N5O6S

Methyl 1-(dimethylsulfamoyl)-2-(methylamino)-6-nitro-1H-benzimidazole-5-carboxylate

  • Molecular FormulaC12H15N5O6S
  • Average mass357.342 Da
  • Monoisotopic mass357.074310 Da
  • ChemSpider ID26586041

More details:

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

1-(Diméthylsulfamoyl)-2-(méthylamino)-6-nitro-1H-benzimidazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
1H-Benzimidazole-5-carboxylic acid, 1-[(dimethylamino)sulfonyl]-2-(methylamino)-6-nitro-, methyl ester [ACD/Index Name]
Methyl 1-(dimethylsulfamoyl)-2-(methylamino)-6-nitro-1H-benzimidazole-5-carboxylate [ACD/IUPAC Name]
Methyl-1-(dimethylsulfamoyl)-2-(methylamino)-6-nitro-1H-benzimidazol-5-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 535.8±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.8±30.9 °C
Index of Refraction: 1.663
Molar Refractivity: 83.7±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.13
ACD/LogD (pH 5.5): 0.84
ACD/BCF (pH 5.5): 2.57
ACD/KOC (pH 5.5): 68.38
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 2.57
ACD/KOC (pH 7.4): 68.38
Polar Surface Area: 148 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 63.5±7.0 dyne/cm
Molar Volume: 225.7±7.0 cm3

Click to predict properties on the Chemicalize site


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