ChemSpider 2D Image | 2'-Deoxy-5'-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]methyl}phosphoryl)adenosine | C11H18N5O11P3

2'-Deoxy-5'-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]methyl}phosphoryl)adenosine

  • Molecular FormulaC11H18N5O11P3
  • Average mass489.209 Da
  • Monoisotopic mass489.021576 Da
  • ChemSpider ID25035897

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2'-Deoxy-5'-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]methyl}phosphoryl)adenosine [ACD/IUPAC Name]
2'-Desoxy-5'-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]methyl}phosphoryl)adenosin [German] [ACD/IUPAC Name]
2'-Désoxy-5'-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]méthyl}phosphoryl)adénosine [French] [ACD/IUPAC Name]
Adenosine, 2'-deoxy-5'-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]methyl]phosphinyl]- [ACD/Index Name]
F2A

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

Density: 2.4±0.1 g/cm3
Boiling Point: 930.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.8±3.0 kJ/mol
Flash Point: 516.6±37.1 °C
Index of Refraction: 1.859
Molar Refractivity: 92.2±0.5 cm3
#H bond acceptors: 16
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -5.63
ACD/LogD (pH 5.5): -11.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 279 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 166.0±7.0 dyne/cm
Molar Volume: 204.8±7.0 cm3

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