ChemSpider 2D Image | 1-[1-(Methylsulfonyl)-3-azetidinyl]methanesulfonamide | C5H12N2O4S2

1-[1-(Methylsulfonyl)-3-azetidinyl]methanesulfonamide

  • Molecular FormulaC5H12N2O4S2
  • Average mass228.290 Da
  • Monoisotopic mass228.023849 Da
  • ChemSpider ID65414790

More details:






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

1-[1-(Methylsulfonyl)-3-azetidinyl]methanesulfonamide [ACD/IUPAC Name]
1-[1-(Méthylsulfonyl)-3-azétidinyl]méthanesulfonamide [French] [ACD/IUPAC Name]
1-[1-(Methylsulfonyl)-3-azetidinyl]methansulfonamid [German] [ACD/IUPAC Name]
3-Azetidinemethanesulfonamide, 1-(methylsulfonyl)- [ACD/Index Name]
(1-methanesulfonylazetidin-3-yl)methanesulfonamide
2172505-78-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 435.0±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.9±30.4 °C
Index of Refraction: 1.586
Molar Refractivity: 48.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.78
ACD/LogD (pH 5.5): -1.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.61
ACD/LogD (pH 7.4): -1.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.60
Polar Surface Area: 114 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 68.6±5.0 dyne/cm
Molar Volume: 143.8±5.0 cm3

Click to predict properties on the Chemicalize site






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