ChemSpider 2D Image | 9-[(3xi)-5-O-(~13~C_5_)Phosphono-beta-D-threo-pentofuranosyl]-9H-purin-6-ol | C513C5H13N4O8P


  • Molecular FormulaC513C5H13N4O8P
  • Average mass353.169 Da
  • Monoisotopic mass353.063873 Da
  • ChemSpider ID58785767
  • defined stereocentres - 3 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

9-[(3ξ)-5-O-(13C5)Phosphono-β-D-threo-pentofuranosyl]-9H-purin-6-ol [German] [ACD/IUPAC Name]
9-[(3ξ)-5-O-(13C5)Phosphono-β-D-threo-pentofuranosyl]-9H-purin-6-ol [ACD/IUPAC Name]
9-[(3ξ)-5-O-(13C5)Phosphono-β-D-thréo-pentofuranosyl]-9H-purin-6-ol [French] [ACD/IUPAC Name]
9H-Purin-6-ol, 9-[(3ξ)-5-O-(phosphono-13C5)-β-D-threo-pentofuranosyl]- [ACD/Index Name]

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

Density: 2.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.882
Molar Refractivity: 68.8±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 137.4±7.0 dyne/cm
Molar Volume: 150.1±7.0 cm3

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