ChemSpider 2D Image | 2-Amino-9-{2-deoxy-5-O-[({[fluoro(phosphono)methyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one | C11H17FN5O12P3

2-Amino-9-{2-deoxy-5-O-[({[fluoro(phosphono)methyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC11H17FN5O12P3
  • Average mass523.199 Da
  • Monoisotopic mass523.007080 Da
  • ChemSpider ID22377244

More details:

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

2-Amino-9-{2-deoxy-5-O-[({[fluoro(phosphono)methyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-{2-desoxy-5-O-[({[fluor(phosphono)methyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-{2-désoxy-5-O-[({[fluoro(phosphono)méthyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 2-amino-9-[2-deoxy-5-O-[[[(fluorophosphonomethyl)hydroxyphosphinyl]oxy]hydroxyphosphinyl]pentofuranosyl]-1,9-dihydro- [ACD/Index Name]

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

Density: 2.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.868
Molar Refractivity: 92.9±0.5 cm3
#H bond acceptors: 17
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -5.12
ACD/LogD (pH 5.5): -11.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 295 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 171.0±7.0 dyne/cm
Molar Volume: 204.9±7.0 cm3

Click to predict properties on the Chemicalize site


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