ChemSpider 2D Image | N-{[4-(1,3-Benzodioxol-5-yl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-N-methylmethanesulfonamide | C12H14N4O5S

N-{[4-(1,3-Benzodioxol-5-yl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-N-methylmethanesulfonamide

  • Molecular FormulaC12H14N4O5S
  • Average mass326.328 Da
  • Monoisotopic mass326.068481 Da
  • ChemSpider ID29669747

More details:

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

Methanesulfonamide, N-[[4-(1,3-benzodioxol-5-yl)-4,5-dihydro-5-oxo-1H-1,2,4-triazol-3-yl]methyl]-N-methyl- [ACD/Index Name]
N-{[4-(1,3-Benzodioxol-5-yl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-N-methylmethanesulfonamide [ACD/IUPAC Name]
N-{[4-(1,3-Benzodioxol-5-yl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]méthyl}-N-méthylméthanesulfonamide [French] [ACD/IUPAC Name]
N-{[4-(1,3-Benzodioxol-5-yl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-N-methylmethansulfonamid [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.699
Molar Refractivity: 77.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.41
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.72
ACD/LogD (pH 7.4): -2.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 66.3±7.0 dyne/cm
Molar Volume: 200.1±7.0 cm3

Click to predict properties on the Chemicalize site


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