ChemSpider 2D Image | 9-(5-O-Phosphonopentofuranosyl)-3,9-dihydro-1H-purine-2,6-dione | C10H13N4O9P

9-(5-O-Phosphonopentofuranosyl)-3,9-dihydro-1H-purine-2,6-dione

  • Molecular FormulaC10H13N4O9P
  • Average mass364.205 Da
  • Monoisotopic mass364.042023 Da
  • ChemSpider ID21230604

More details:






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

1H-Purine-2,6-dione, 3,9-dihydro-9-(5-O-phosphonopentofuranosyl)- [ACD/Index Name]
9-(5-O-Phosphonopentofuranosyl)-3,9-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
9-(5-O-Phosphonopentofuranosyl)-3,9-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
9-(5-O-Phosphonopentofuranosyl)-3,9-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC Name]

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

Density: 2.5±0.1 g/cm3
Boiling Point: 938.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 143.0±3.0 kJ/mol
Flash Point: 521.1±37.1 °C
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: -1.63
ACD/LogD (pH 5.5): -7.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 210 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 154.6±7.0 dyne/cm
Molar Volume: 147.4±7.0 cm3

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