ChemSpider 2D Image | 9-{5-O-[Hydroxy({hydroxy[(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-9H-purin-6-amine | C10H18N5O19P5

9-{5-O-[Hydroxy({hydroxy[(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-9H-purin-6-amine

  • Molecular FormulaC10H18N5O19P5
  • Average mass667.141 Da
  • Monoisotopic mass666.928406 Da
  • ChemSpider ID4810155

More details:

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

9-{5-O-[Hydroxy({hydroxy[(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-{5-O-[Hydroxy({hydroxy[(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-9H-purin-6-amine [ACD/IUPAC Name]
9-{5-O-[Hydroxy({hydroxy[(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-[5-O-[hydroxy[[hydroxy[[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]oxy]phosphinyl]oxy]phosphinyl]pentofuranosyl]- [ACD/Index Name]

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

Density: 2.8±0.0 g/cm3
Boiling Point: 1086.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 167.0±0.0 kJ/mol
Flash Point: 610.7±0.0 °C
Index of Refraction: 1.905
Molar Refractivity: 109.7±0.0 cm3
#H bond acceptors: 24
#H bond donors: 10
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -5.57
ACD/LogD (pH 5.5): -13.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -13.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 421 Å2
Polarizability: 43.5±0.0 10-24cm3
Surface Tension: 241.9±0.0 dyne/cm
Molar Volume: 235.0±0.0 cm3

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