ChemSpider 2D Image | 1-(5-O-Phosphono-beta-D-ribofuranosyl)-1H-pyrazolo[3,4-d]pyrimidine-4,6(2H,5H)-dione | C10H13N4O9P

1-(5-O-Phosphono-β-D-ribofuranosyl)-1H-pyrazolo[3,4-d]pyrimidine-4,6(2H,5H)-dione

  • Molecular FormulaC10H13N4O9P
  • Average mass364.205 Da
  • Monoisotopic mass364.042023 Da
  • ChemSpider ID95601299
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

1-(5-O-Phosphono-β-D-ribofuranosyl)-1H-pyrazolo[3,4-d]pyrimidin-4,6(2H,5H)-dion [German] [ACD/IUPAC Name]
1-(5-O-Phosphono-β-D-ribofuranosyl)-1H-pyrazolo[3,4-d]pyrimidine-4,6(2H,5H)-dione [ACD/IUPAC Name]
1-(5-O-Phosphono-β-D-ribofuranosyl)-1H-pyrazolo[3,4-d]pyrimidine-4,6(2H,5H)-dione [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-d]pyrimidine-4,6(2H,5H)-dione, 1-(5-O-phosphono-β-D-ribofuranosyl)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.921
Molar Refractivity: 69.7±0.5 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -2.10
ACD/LogD (pH 5.5): -6.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 200 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 154.6±7.0 dyne/cm
Molar Volume: 147.4±7.0 cm3

Click to predict properties on the Chemicalize site






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