ChemSpider 2D Image | 9-{5-O-[Hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one | C10H14N4O11P2

9-{5-O-[Hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC10H14N4O11P2
  • Average mass428.186 Da
  • Monoisotopic mass428.013428 Da
  • ChemSpider ID21537266

More details:

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

6H-Purin-6-one, 1,9-dihydro-9-[5-O-[hydroxy(phosphonooxy)phosphinyl]pentofuranosyl]- [ACD/Index Name]
9-{5-O-[Hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
9-{5-O-[Hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
9-{5-O-[Hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.884
Molar Refractivity: 78.8±0.5 cm3
#H bond acceptors: 15
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -3.71
ACD/LogD (pH 5.5): -9.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 242 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 167.2±7.0 dyne/cm
Molar Volume: 171.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement