ChemSpider 2D Image | 1,2,4-Oxathiazinan-6-one | C3H5NO2S

1,2,4-Oxathiazinan-6-one

  • Molecular FormulaC3H5NO2S
  • Average mass119.142 Da
  • Monoisotopic mass119.004097 Da
  • ChemSpider ID32977200

More details:

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

1,2,4-Oxathiazin-6(3H)-one, dihydro- [ACD/Index Name]
1,2,4-Oxathiazinan-6-on [German] [ACD/IUPAC Name]
1,2,4-Oxathiazinan-6-one [ACD/IUPAC Name]
1,2,4-Oxathiazinan-6-one [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 207.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.4±3.0 kJ/mol
Flash Point: 79.2±30.1 °C
Index of Refraction: 1.517
Molar Refractivity: 27.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.03
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.92
ACD/LogD (pH 7.4): -0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.53
Polar Surface Area: 64 Å2
Polarizability: 10.7±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 89.5±3.0 cm3

Click to predict properties on the Chemicalize site


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