ChemSpider 2D Image | 1-(1,3,4-Thiadiazol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione | C6H4N4O3S

1-(1,3,4-Thiadiazol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione

  • Molecular FormulaC6H4N4O3S
  • Average mass212.186 Da
  • Monoisotopic mass212.000412 Da
  • ChemSpider ID72397565

More details:

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

1-(1,3,4-Thiadiazol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione [ACD/IUPAC Name]
1-(1,3,4-Thiadiazol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione [French] [ACD/IUPAC Name]
1-(1,3,4-Thiadiazol-2-yl)-2,4,6(1H,3H,5H)-pyrimidintrion [German] [ACD/IUPAC Name]
2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-(1,3,4-thiadiazol-2-yl)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.647
Molar Refractivity: 44.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.71
ACD/LogD (pH 5.5): -3.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 91.1±3.0 dyne/cm
Molar Volume: 123.2±3.0 cm3

Click to predict properties on the Chemicalize site


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