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  • NCIOpen2_003509,NSC68278,6967-22-2, 9-bromo-1-fluoro-9H-fluorene,Canon
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]
    NCIOpen2_003509
    NSC68278
    6967-22-2

    [Structure]
    NCIOpen2_003509,NSC68278,6967-22-2, 9-bromo-1-fluoro-9H-fluorene,Canon

    [ Properties Computed from Structure]
    Molecular Weight263.105023 [g/mol]
    Molecular FormulaC13H8BrF
    XLogP4.4
    H-Bond Donor0
    H-Bond Acceptor1
    Rotatable Bond Count0
    Exact Mass261.979341
    MonoIsotopic Mass261.979341
    Topological Polar Surface Area0
    Heavy Atom Count15
    Formal Charge0
    Complexity243
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count1
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: 9-bromo-1-fluoro-9H-fluorene
    Canonical SMILES: C1=CC=C2C3=C(C(C2=C1)Br)C(=CC=C3)F
    InChI: InChI=1/C13H8BrF/c14-13-10-5-2-1-4-8(10)9-6-3-7-11(15)12(9)13/h1-7,13H

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