ChemSpider 2D Image | 3-(Methylsulfanyl)-1,2,4-oxadiazolidin-5-amine | C3H9N3OS

3-(Methylsulfanyl)-1,2,4-oxadiazolidin-5-amine

  • Molecular FormulaC3H9N3OS
  • Average mass135.188 Da
  • Monoisotopic mass135.046631 Da
  • ChemSpider ID109920206

More details:

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

1,2,4-Oxadiazolidin-5-amine, 3-(methylthio)- [ACD/Index Name]
3-(Methylsulfanyl)-1,2,4-oxadiazolidin-5-amin [German] [ACD/IUPAC Name]
3-(Methylsulfanyl)-1,2,4-oxadiazolidin-5-amine [ACD/IUPAC Name]
3-(Méthylsulfanyl)-1,2,4-oxadiazolidin-5-amine [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: 242.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.9±3.0 kJ/mol
Flash Point: 100.2±30.1 °C
Index of Refraction: 1.602
Molar Refractivity: 34.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.83
ACD/LogD (pH 5.5): -4.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability: 13.7±0.5 10-24cm3
Surface Tension: 55.9±5.0 dyne/cm
Molar Volume: 100.7±5.0 cm3

Click to predict properties on the Chemicalize site


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