ChemSpider 2D Image | 2-Ammonio-9-[2-deoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)pentofuranosyl]-6-oxo-6,9-dihydro-1H-purin-7-ium | C10H14N5O13P3

2-Ammonio-9-[2-deoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)pentofuranosyl]-6-oxo-6,9-dihydro-1H-purin-7-ium

  • Molecular FormulaC10H14N5O13P3
  • Average mass505.166 Da
  • Monoisotopic mass504.981201 Da
  • ChemSpider ID21238893

  • Charge - Charge

More details:

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

2-Ammonio-9-[2-deoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)pentofuranosyl]-6-oxo-6,9-dihydro-1H-purin-7-ium [ACD/IUPAC Name]
2-Ammonio-9-[2-desoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)pentofuranosyl]-6-oxo-6,9-dihydro-1H-purin-7-ium [German] [ACD/IUPAC Name]
2-Ammonio-9-[2-désoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)pentofuranosyl]-6-oxo-6,9-dihydro-1H-purin-7-ium [French] [ACD/IUPAC Name]
2H-Purin-6-olato(2-), 9-[2-deoxy-5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]pentofuranosyl]-3,9-dihydro-2-imino-, bis(inner salt), ion(2-) [ACD/Index Name]

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

Density:
Boiling Point: 975.0±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 148.8±3.0 kJ/mol
Flash Point: 543.5±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 18
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -6.69
ACD/LogD (pH 5.5): -12.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 319 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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