ChemSpider 2D Image | 9-[2-Deoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-beta-D-(~13~C_5_,2-~2~H_1_)arabinofuranosyl](~13~C_5_,~15~N_4_)-9H-purin-6-(~15~N)amine | 13C10H15D15N5O12P3

9-[2-Deoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-(13C5,2-2H1)arabinofuranosyl](13C5,15N4)-9H-purin-6-(15N)amine

  • Molecular Formula13C10H15D15N5O12P3
  • Average mass507.081 Da
  • Monoisotopic mass507.025818 Da
  • ChemSpider ID9447137

  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

9-[2-Deoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-(13C5,2-2H1)arabinofuranosyl](13C5,15N4)-9H-purin-6-(15N)amine [ACD/IUPAC Name]
9-[2-Desoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-(13C5,2-2H1)arabinofuranosyl](13C5,15N4)-9H-purin-6-(15N)amin [German] [ACD/IUPAC Name]
9-[2-Désoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-(13C5,2-2H1)arabinofuranosyl](13C5,15N4)-9H-purin-6-(15N)amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine-2,4,5,6,8-13C5-1,3,7,9-15N5, 9-[2-deoxy-5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-β-D-arabinofuranosyl-13C5-2-d]- [ACD/Index Name]

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

Density: 2.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.874
Molar Refractivity: 89.0±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: 35.3±0.5 10-24cm3
Surface Tension: 180.6±7.0 dyne/cm
Molar Volume: 195.2±7.0 cm3

Click to predict properties on the Chemicalize site


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