ChemSpider 2D Image | (4aR,6R,7S,7aR)-6-[6-Amino(4,8-~13~C_2_,7-~15~N)-9H-purin-9-yl]tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide | C813C2H12N415NO6P

(4aR,6R,7S,7aR)-6-[6-Amino(4,8-13C2,7-15N)-9H-purin-9-yl]tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide

  • Molecular FormulaC813C2H12N415NO6P
  • Average mass332.185 Da
  • Monoisotopic mass332.056274 Da
  • ChemSpider ID107443967

  • defined stereocentres - 4 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(4aR,6R,7S,7aR) 2-Oxyde de 6-[6-amino(4,8-13C2,7-15N)-9H-purin-9-yl]tétrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol [French] [ACD/IUPAC Name]
(4aR,6R,7S,7aR)-6-[6-Amino(4,8-13C2,7-15N)-9H-purin-9-yl]tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2,7-diol-2-oxid [German] [ACD/IUPAC Name]
(4aR,6R,7S,7aR)-6-[6-Amino(4,8-13C2,7-15N)-9H-purin-9-yl]tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide [ACD/IUPAC Name]
4H-Furo[3,2-d]-1,3,2-dioxaphosphorin-7-ol, 6-(6-amino-9H-purin-9-yl-4,8-13C2-7-15N)tetrahydro-2-hydroxy-, 2-oxide, (4aR,6R,7S,7aR)- [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: 2.012
Molar Refractivity: 67.0±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: 26.6±0.5 10-24cm3
Surface Tension: 153.8±7.0 dyne/cm
Molar Volume: 133.1±7.0 cm3

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