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    CAS 56341-41-4

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 56341-41-4, 5-fluoro-2-oxindole, 5-fluoroindolin-2-one, 5-fluoro-1,3-dihydroindol-2-one, 2h-indol-2-one, 5-fluoro-1,3-dihydro-, 5-fluoro-1,3-dihydro-2h-indol-2-one
    Molecular Formula
    C8H6FNO
    Molecular Weight
    151.14  g/mol
    InChI Key
    DDIIYGHHUMKDGI-UHFFFAOYSA-N
    FDA UNII
    4EW64J5JHC
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-fluoro-1,3-dihydroindol-2-one
    2.1.2 InChI
    InChI=1S/C8H6FNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11)
    2.1.3 InChI Key
    DDIIYGHHUMKDGI-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1C2=C(C=CC(=C2)F)NC1=O
    2.2 Other Identifiers
    2.2.1 UNII
    4EW64J5JHC
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 56341-41-4

    2. 5-fluoro-2-oxindole

    3. 5-fluoroindolin-2-one

    4. 5-fluoro-1,3-dihydroindol-2-one

    5. 2h-indol-2-one, 5-fluoro-1,3-dihydro-

    6. 5-fluoro-1,3-dihydro-2h-indol-2-one

    7. 5-fluoro-1,3-dihydro-indol-2-one

    8. 5-fluoro-2,3-dihydro-1h-indol-2-one

    9. 5-fluoro-2-oxoindoline

    10. Mfcd02179598

    11. 4ew64j5jhc

    12. 5-fluoranyl-1,3-dihydroindol-2-one

    13. 5-fluorooxindole (5-fluoro-1,3-dihydro-2h-indol-2-one)

    14. 5-fluoro-2-indolinone

    15. 5-fluoro-2,3-dihydro-2-oxoindole

    16. 5-fluoroindolinone

    17. 5-fluoro Oxindole

    18. 5-fluoro-oxindole

    19. Unii-4ew64j5jhc

    20. Schembl152963

    21. 5-fluoro-2-oxindole, 97%

    22. Dtxsid40395649

    23. Act02482

    24. Bcp27225

    25. Zinc2577869

    26. 5-fluoro-1, 3-dihydroindol-2-one

    27. 5-fluoro-1,3-dihydro-indo1-2-one

    28. 5-fluoro-1,3-dihydro-indole-2-one

    29. Bbl012822

    30. Stk787818

    31. 2,6-dimethyl-3,5-dinitrobenzoicacid

    32. Akos005255291

    33. Ab11374

    34. Ac-2684

    35. Bcp9000184

    36. Bh-0437

    37. Cs-w002914

    38. 5-fluoro-1.3-dihydro-2h-indol-2-one

    39. Bp-21383

    40. Sy002547

    41. Db-007049

    42. A8088

    43. Am20040727

    44. F0699

    45. Ft-0601322

    46. 341f414

    47. Q-101341

    2.4 Create Date
    2005-09-10
    3 Chemical and Physical Properties
    Molecular Weight 151.14 g/mol
    Molecular Formula C8H6FNO
    XLogP31.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass151.043341977 g/mol
    Monoisotopic Mass151.043341977 g/mol
    Topological Polar Surface Area29.1 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity183
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1