ChemSpider 2D Image | 2-Amino-9-[2-deoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-beta-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one | C10H12N5O13P3

2-Amino-9-[2-deoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-β-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC10H12N5O13P3
  • Average mass503.151 Da
  • Monoisotopic mass502.966644 Da
  • ChemSpider ID34890773

  • Charge - Charge

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2-Amino-9-[2-deoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-β-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-[2-desoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-β-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-[2-désoxy-5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-β-D-thréo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 2-amino-9-[2-deoxy-5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-β-D-threo-pentofuranosyl]-1,9-dihydro-, ion(4-) [ACD/Index Name]
CHEMBL194007

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: 8
#Rule of 5 Violations: 3
ACD/LogP: -5.14
ACD/LogD (pH 5.5): -11.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 315 Å2
Polarizability:
Surface Tension:
Molar Volume:

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