ChemSpider 2D Image | Methyl {6-[(~2~H_7_)propylsulfinyl]-1H-benzimidazol-2-yl}carbamate | C12H8D7N3O3S

Methyl {6-[(2H7)propylsulfinyl]-1H-benzimidazol-2-yl}carbamate

  • Molecular FormulaC12H8D7N3O3S
  • Average mass288.374 Da
  • Monoisotopic mass288.127350 Da
  • ChemSpider ID58782490
  • Non-standard isotope - Non-standard isotope


More details:






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

{6-[(2H7)Propylsulfinyl]-1H-benzimidazol-2-yl}carbamate de méthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[6-(propyl-d7-sulfinyl)-1H-benzimidazol-2-yl]-, methyl ester [ACD/Index Name]
Methyl {6-[(2H7)propylsulfinyl]-1H-benzimidazol-2-yl}carbamate [ACD/IUPAC Name]
Methyl-{6-[(2H7)propylsulfinyl]-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: 1.659
Molar Refractivity: 73.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 4.19
ACD/KOC (pH 5.5): 90.56
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.25
ACD/KOC (pH 7.4): 113.41
Polar Surface Area: 103 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 76.8±5.0 dyne/cm
Molar Volume: 199.5±5.0 cm3

Click to predict properties on the Chemicalize site






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