ChemSpider 2D Image | 6-Methyl(3-~2~H)-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide | C4H4DNO4S

6-Methyl(3-2H)-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide

  • Molecular FormulaC4H4DNO4S
  • Average mass164.158 Da
  • Monoisotopic mass164.000198 Da
  • ChemSpider ID95581467

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2,3-Oxathiazin-4(3H)-one-3-d, 6-methyl-, 2,2-dioxide [ACD/Index Name]
2,2-Dioxyde de 6-méthyl(3-2H)-1,2,3-oxathiazin-4(3H)-one [French] [ACD/IUPAC Name]
6-Methyl(3-2H)-1,2,3-oxathiazin-4(3H)-on-2,2-dioxid [German] [ACD/IUPAC Name]
6-Methyl(3-2H)-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.515
Molar Refractivity: 32.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.32
ACD/LogD (pH 5.5): -2.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 107.9±3.0 cm3

Click to predict properties on the Chemicalize site


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