ChemSpider 2D Image | 5-Methyl-1,3,4-oxathiazolidin-2-one | C3H5NO2S

5-Methyl-1,3,4-oxathiazolidin-2-one

  • Molecular FormulaC3H5NO2S
  • Average mass119.142 Da
  • Monoisotopic mass119.004097 Da
  • ChemSpider ID113450195

More details:






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

1,3,4-Oxathiazolidin-2-one, 5-methyl- [ACD/Index Name]
5-Methyl-1,3,4-oxathiazolidin-2-on [German] [ACD/IUPAC Name]
5-Methyl-1,3,4-oxathiazolidin-2-one [ACD/IUPAC Name]
5-Méthyl-1,3,4-oxathiazolidin-2-one [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 143.9±23.0 °C at 760 mmHg
Vapour Pressure: 5.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.1±3.0 kJ/mol
Flash Point: 40.8±22.6 °C
Index of Refraction: 1.504
Molar Refractivity: 27.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.59
ACD/LogD (pH 5.5): 0.45
ACD/BCF (pH 5.5): 1.30
ACD/KOC (pH 5.5): 42.04
ACD/LogD (pH 7.4): 0.45
ACD/BCF (pH 7.4): 1.30
ACD/KOC (pH 7.4): 42.04
Polar Surface Area: 64 Å2
Polarizability: 10.8±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 91.8±3.0 cm3

Click to predict properties on the Chemicalize site






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