ChemSpider 2D Image | 1,3-Oxathiolan-2-imine | C3H5NOS

1,3-Oxathiolan-2-imine

  • Molecular FormulaC3H5NOS
  • Average mass103.143 Da
  • Monoisotopic mass103.009186 Da
  • ChemSpider ID25942818

More details:

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

1,3-Oxathiolan-2-imin [German] [ACD/IUPAC Name]
1,3-Oxathiolan-2-imine [ACD/Index Name] [ACD/IUPAC Name]
1,3-Oxathiolan-2-imine [French] [ACD/IUPAC Name]
1,3-oxathiolane-2-imine
2-imino-1,3-oxathiolane
5638-38-0 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 118.5±23.0 °C at 760 mmHg
Vapour Pressure: 19.8±0.2 mmHg at 25°C
Enthalpy of Vaporization: 34.2±3.0 kJ/mol
Flash Point: 25.5±22.6 °C
Index of Refraction: 1.637
Molar Refractivity: 24.9±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.55
ACD/LogD (pH 5.5): -0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.05
ACD/LogD (pH 7.4): -0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.77
Polar Surface Area: 58 Å2
Polarizability: 9.9±0.5 10-24cm3
Surface Tension: 57.4±7.0 dyne/cm
Molar Volume: 69.5±7.0 cm3

Click to predict properties on the Chemicalize site


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