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  • 4-Caprylylmorpholine,4-Octanoylmorpholine,Morpholine, 4-caprylyl-,Morp
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]
    4-Caprylylmorpholine
    4-Octanoylmorpholine
    Morpholine, 4-caprylyl-
    Morpholine, 4-octanoyl-
    Octanoic acid, morpholide
    4-(1-Oxooctyl)morpholine
    1-(Morpholino)-1-octanone
    1-Octanone, 1-(morpholino)-
    Morpholine, 4-(1-oxooctyl)-
    NSC 3186

    [Structure]
    4-Caprylylmorpholine,4-Octanoylmorpholine,Morpholine, 4-caprylyl-,Morp

    [ Properties Computed from Structure]
    Molecular Weight213.31652 [g/mol]
    Molecular FormulaC12H23NO2
    XLogP2.6
    H-Bond Donor0
    H-Bond Acceptor2
    Rotatable Bond Count6
    Exact Mass213.172879
    MonoIsotopic Mass213.172879
    Topological Polar Surface Area29.5
    Heavy Atom Count15
    Formal Charge0
    Complexity177
    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: 1-morpholin-4-yloctan-1-one
    Canonical SMILES: CCCCCCCC(=O)N1CCOCC1
    InChI: InChI=1/C12H23NO2/c1-2-3-4-5-6-7-12(14)13-8-10-15-11-9-13/h2-11H2,1H3

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