ChemSpider 2D Image | 1-{(2R,4S,5R)-5-[Difluoro(hydroxy)methyl]-5-fluoro-4-hydroxytetrahydro-2-furanyl}-5-methyl-2,4(1H,3H)-pyrimidinedione | C10H11F3N2O5

1-{(2R,4S,5R)-5-[Difluoro(hydroxy)methyl]-5-fluoro-4-hydroxytetrahydro-2-furanyl}-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC10H11F3N2O5
  • Average mass296.200 Da
  • Monoisotopic mass296.062012 Da
  • ChemSpider ID32865511

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-{(2R,4S,5R)-5-[Difluor(hydroxy)methyl]-5-fluor-4-hydroxytetrahydro-2-furanyl}-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-{(2R,4S,5R)-5-[Difluoro(hydroxy)methyl]-5-fluoro-4-hydroxytetrahydro-2-furanyl}-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-{(2R,4S,5R)-5-[Difluoro(hydroxy)méthyl]-5-fluoro-4-hydroxytétrahydro-2-furanyl}-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
1-[(2R,4S,5R)-5-[difluoro(hydroxy)methyl]-5-fluoro-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
70-00-8 [RN]
Trifluorothymidine
Trifluridine [INN] [USAN] [USP] [Wiki]

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

    Density: 1.7±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.557
    Molar Refractivity: 56.8±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.41
    ACD/LogD (pH 5.5): 0.34
    ACD/BCF (pH 5.5): 1.06
    ACD/KOC (pH 5.5): 36.25
    ACD/LogD (pH 7.4): 0.33
    ACD/BCF (pH 7.4): 1.04
    ACD/KOC (pH 7.4): 35.62
    Polar Surface Area: 99 Å2
    Polarizability: 22.5±0.5 10-24cm3
    Surface Tension: 59.5±5.0 dyne/cm
    Molar Volume: 176.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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