ChemSpider 2D Image | (3xi)-2-Fluoroadenosine | C10H12FN5O4

(3ξ)-2-Fluoroadenosine

  • Molecular FormulaC10H12FN5O4
  • Average mass285.232 Da
  • Monoisotopic mass285.087341 Da
  • ChemSpider ID58785091

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(3ξ)-2-Fluoradenosin [German] [ACD/IUPAC Name]
(3ξ)-2-Fluoroadenosine [ACD/IUPAC Name]
(3ξ)-2-Fluoroadénosine [French] [ACD/IUPAC Name]
Adenosine, 2-fluoro-, (3ξ)- [ACD/Index Name]
(2R,3R,5R)-2-(6-amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
21679-14-1 [RN]
Fludarabine [INN] [Wiki]

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

    Density: 2.2±0.1 g/cm3
    Boiling Point: 747.3±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 114.3±3.0 kJ/mol
    Flash Point: 405.8±35.7 °C
    Index of Refraction: 1.876
    Molar Refractivity: 59.8±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 5
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 1
    ACD/LogP: -0.40
    ACD/LogD (pH 5.5): -0.86
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 8.11
    ACD/LogD (pH 7.4): -0.86
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 8.11
    Polar Surface Area: 140 Å2
    Polarizability: 23.7±0.5 10-24cm3
    Surface Tension: 98.6±7.0 dyne/cm
    Molar Volume: 131.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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