ChemSpider 2D Image | 3-(Methylsulfanyl)-5-(1,2,3-thiadiazol-5-yl)-1,2,4-oxadiazole | C5H4N4OS2

3-(Methylsulfanyl)-5-(1,2,3-thiadiazol-5-yl)-1,2,4-oxadiazole

  • Molecular FormulaC5H4N4OS2
  • Average mass200.242 Da
  • Monoisotopic mass199.982651 Da
  • ChemSpider ID61228198

More details:

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

1,2,4-Oxadiazole, 3-(methylthio)-5-(1,2,3-thiadiazol-5-yl)- [ACD/Index Name]
3-(Methylsulfanyl)-5-(1,2,3-thiadiazol-5-yl)-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
3-(Methylsulfanyl)-5-(1,2,3-thiadiazol-5-yl)-1,2,4-oxadiazole [ACD/IUPAC Name]
3-(Méthylsulfanyl)-5-(1,2,3-thiadiazol-5-yl)-1,2,4-oxadiazole [French] [ACD/IUPAC Name]
1862915-44-3 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 378.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.2±3.0 kJ/mol
Flash Point: 182.9±30.7 °C
Index of Refraction: 1.660
Molar Refractivity: 45.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.56
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 6.03
ACD/KOC (pH 5.5): 125.98
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 6.03
ACD/KOC (pH 7.4): 125.98
Polar Surface Area: 118 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 97.3±5.0 dyne/cm
Molar Volume: 124.3±5.0 cm3

Click to predict properties on the Chemicalize site


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