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  • NSC52227,6935-40-6, N-(4-nitroso-2,3-dihydronaphthalen-1-yl)hydroxylam
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]
    NSC52227
    6935-40-6

    [Structure]
    NSC52227,6935-40-6, N-(4-nitroso-2,3-dihydronaphthalen-1-yl)hydroxylam

    [ Properties Computed from Structure]
    Molecular Weight190.1986 [g/mol]
    Molecular FormulaC10H10N2O2
    XLogP0.7
    H-Bond Donor2
    H-Bond Acceptor4
    Rotatable Bond Count1
    Tautomer Count4
    Exact Mass190.074228
    MonoIsotopic Mass190.074228
    Topological Polar Surface Area61.7
    Heavy Atom Count14
    Formal Charge0
    Complexity389
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: N-(4-nitroso-2,3-dihydronaphthalen-1-yl)hydroxylamine
    Canonical SMILES: C1CC(=C2C=CC=CC2=C1NO)N=O
    InChI: InChI=1/C10H10N2O2/c13-11-9-5-6-10(12-14)8-4-2-1-3-7(8)9/h1-4,11,13H,
    5-6H2

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