ChemSpider 2D Image | 1H-Pyrazolo[4,3-d]pyrimidine-3,5,7(2H,4H,6H)-trione | C5H4N4O3

1H-Pyrazolo[4,3-d]pyrimidine-3,5,7(2H,4H,6H)-trione

  • Molecular FormulaC5H4N4O3
  • Average mass168.110 Da
  • Monoisotopic mass168.028336 Da
  • ChemSpider ID23370003

More details:

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

1H-Pyrazolo[4,3-d]pyrimidin-3,5,7(2H,4H,6H)-trion [German] [ACD/IUPAC Name]
1H-Pyrazolo[4,3-d]pyrimidine-3,5,7(2H,4H,6H)-trione [ACD/Index Name] [ACD/IUPAC Name]
1H-Pyrazolo[4,3-d]pyrimidine-3,5,7(2H,4H,6H)-trione [French] [ACD/Index Name] [ACD/IUPAC Name]
745814-52-2 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.721
Molar Refractivity: 35.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -2.37
ACD/LogD (pH 5.5): -1.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.23
ACD/LogD (pH 7.4): -1.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.12
Polar Surface Area: 99 Å2
Polarizability: 14.1±0.5 10-24cm3
Surface Tension: 94.4±5.0 dyne/cm
Molar Volume: 89.8±5.0 cm3

Click to predict properties on the Chemicalize site


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