ChemSpider 2D Image | Methyl {5-[(2,2,3,3,3-~2~H_5_)propylsulfonyl]-1H-benzimidazol-2-yl}carbamate | C12H10D5N3O4S

Methyl {5-[(2,2,3,3,3-2H5)propylsulfonyl]-1H-benzimidazol-2-yl}carbamate

  • Molecular FormulaC12H10D5N3O4S
  • Average mass302.361 Da
  • Monoisotopic mass302.109711 Da
  • ChemSpider ID58779530
  • Non-standard isotope - Non-standard isotope


More details:






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

{5-[(2,2,3,3,3-2H5)Propylsulfonyl]-1H-benzimidazol-2-yl}carbamate de méthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[5-(propyl-2,2,3,3,3-d5-sulfonyl)-1H-benzimidazol-2-yl]-, methyl ester [ACD/Index Name]
Methyl {5-[(2,2,3,3,3-2H5)propylsulfonyl]-1H-benzimidazol-2-yl}carbamate [ACD/IUPAC Name]
Methyl-{5-[(2,2,3,3,3-2H5)propylsulfonyl]-1H-benzimidazol-2-yl}carbamat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.620
Molar Refractivity: 73.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.86
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 3.04
ACD/KOC (pH 5.5): 75.62
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 3.20
ACD/KOC (pH 7.4): 79.68
Polar Surface Area: 110 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 66.3±3.0 dyne/cm
Molar Volume: 209.3±3.0 cm3

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