ChemSpider 2D Image | 2-(~15~N)Amino-8-hydroxy-9-[(3xi)-beta-D-threo-pentofuranosyl](2-~13~C,1-~15~N)-1,9-dihydro-6H-purin-6-one | C913CH13N315N2O6

2-(15N)Amino-8-hydroxy-9-[(3ξ)-β-D-threo-pentofuranosyl](2-13C,1-15N)-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC913CH13N315N2O6
  • Average mass302.220 Da
  • Monoisotopic mass302.084015 Da
  • ChemSpider ID58784242

  • 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

2-(15N)Amino-8-hydroxy-9-[(3ξ)-β-D-threo-pentofuranosyl](2-13C,1-15N)-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-(15N)Amino-8-hydroxy-9-[(3ξ)-β-D-threo-pentofuranosyl](2-13C,1-15N)-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-(15N)Amino-8-hydroxy-9-[(3ξ)-β-D-thréo-pentofuranosyl](2-13C,1-15N)-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one-2-13C-1-15N, 2-(amino-15N)-1,9-dihydro-8-hydroxy-9-[(3ξ)-β-D-threo-pentofuranosyl]- [ACD/Index Name]

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

Density: 2.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 2.007
Molar Refractivity: 61.7±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
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: 24.4±0.5 10-24cm3
Surface Tension: 142.7±7.0 dyne/cm
Molar Volume: 122.7±7.0 cm3

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