ChemSpider 2D Image | 1,4,3-Oxathiazinane 4,4-dioxide | C3H7NO3S

1,4,3-Oxathiazinane 4,4-dioxide

  • Molecular FormulaC3H7NO3S
  • Average mass137.158 Da
  • Monoisotopic mass137.014664 Da
  • ChemSpider ID64860395

More details:






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

1,4,3-Oxathiazinan-4,4-dioxid [German] [ACD/IUPAC Name]
1,4,3-Oxathiazinane 4,4-dioxide [ACD/IUPAC Name]
1,4,3-Oxathiazine, tetrahydro-, 4,4-dioxide [ACD/Index Name]
4,4-Dioxyde de 1,4,3-oxathiazinane [French] [ACD/IUPAC Name]
856785-75-6 [RN]
MFCD30530652

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

Density: 1.4±0.1 g/cm3
Boiling Point: 274.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.3±3.0 kJ/mol
Flash Point: 119.8±30.1 °C
Index of Refraction: 1.473
Molar Refractivity: 28.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -2.14
ACD/LogD (pH 5.5): -1.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.66
ACD/LogD (pH 7.4): -1.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.61
Polar Surface Area: 64 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 39.0±3.0 dyne/cm
Molar Volume: 100.1±3.0 cm3

Click to predict properties on the Chemicalize site






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