ChemSpider 2D Image | 9-(3-Deoxy-3-fluoro-beta-D-ribofuranosyl)-9H-purine | C10H11FN4O3

9-(3-Deoxy-3-fluoro-β-D-ribofuranosyl)-9H-purine

  • Molecular FormulaC10H11FN4O3
  • Average mass254.218 Da
  • Monoisotopic mass254.081512 Da
  • ChemSpider ID34500673

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

9-(3-Deoxy-3-fluoro-β-D-ribofuranosyl)-9H-purine [ACD/IUPAC Name]
9-(3-Désoxy-3-fluoro-β-D-ribofuranosyl)-9H-purine [French] [ACD/IUPAC Name]
9-(3-Desoxy-3-fluor-β-D-ribofuranosyl)-9H-purin [German] [ACD/IUPAC Name]
9H-Purine, 9-(3-deoxy-3-fluoro-β-D-ribofuranosyl)- [ACD/Index Name]
(2R,3S,4S,5R)-4-fluoro-5-(hydroxymethyl)-2-(9H-purin-9-yl)tetrahydrofuran-3-ol
124775-29-7 [RN]
9-(3-deoxy-3-fluoro-β-D-ribofuranosyl)purine
MFCD28125312

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 544.8±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.7±3.0 kJ/mol
    Flash Point: 283.3±32.9 °C
    Index of Refraction: 1.772
    Molar Refractivity: 57.1±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.20
    ACD/LogD (pH 5.5): -0.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 11.28
    ACD/LogD (pH 7.4): -0.60
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 11.30
    Polar Surface Area: 93 Å2
    Polarizability: 22.6±0.5 10-24cm3
    Surface Tension: 72.8±7.0 dyne/cm
    Molar Volume: 137.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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