ChemSpider 2D Image | 2-Amino-9-{2-deoxy-5-O-[hydroxy({hydroxy[(hydroxyphosphinato)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-7-ethyl-6-oxo-6,7-dihydro-1H-purin-9-ium | C12H20N5O13P3

2-Amino-9-{2-deoxy-5-O-[hydroxy({hydroxy[(hydroxyphosphinato)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-7-ethyl-6-oxo-6,7-dihydro-1H-purin-9-ium

  • Molecular FormulaC12H20N5O13P3
  • Average mass535.234 Da
  • Monoisotopic mass535.027039 Da
  • ChemSpider ID120331376

More details:

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

1H-Purinium, 2-amino-9-[2-deoxy-5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]pentofuranosyl]-7-ethyl-6,7-dihydro-6-oxo-, inner salt [ACD/Index Name]
2-Amino-9-{2-deoxy-5-O-[hydroxy({hydroxy[(hydroxyphosphinato)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-7-ethyl-6-oxo-6,7-dihydro-1H-purin-9-ium [ACD/IUPAC Name]
2-Amino-9-{2-desoxy-5-O-[hydroxy({hydroxy[(hydroxyphosphinato)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-7-ethyl-6-oxo-6,7-dihydro-1H-purin-9-ium [German] [ACD/IUPAC Name]
2-Amino-9-{2-désoxy-5-O-[hydroxy({hydroxy[(hydroxyphosphinato)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-7-éthyl-6-oxo-6,7-dihydro-1H-purin-9-ium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 18
#H bond donors: 8
#Freely Rotating Bonds: 9
#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: 298 Å2
Polarizability:
Surface Tension:
Molar Volume:

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