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  • (2R)-3-(4-fluorophenoxy)-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propan-
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight267.339083 [g/mol]
    Molecular FormulaC15H22FNO2
    XLogP2.7
    H-Bond Donor1
    H-Bond Acceptor4
    Rotatable Bond Count7
    Exact Mass267.163457
    MonoIsotopic Mass267.163457
    Topological Polar Surface Area30.5
    Heavy Atom Count19
    Formal Charge0
    Complexity244
    Isotope Atom Count0
    Defined Atom StereoCenter Count2
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: (2R)-3-(4-fluorophenoxy)-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propan-1-
    amine
    Canonical SMILES: CC(CNCC1CCCO1)COC2=CC=C(C=C2)F
    Isomeric SMILES: C[C@H](CNC[C@H]1CCCO1)COC2=CC=C(C=C2)F
    InChI: InChI=1/C15H22FNO2/c1-12(9-17-10-15-3-2-8-18-15)11-19-14-6-4-13(16)5-7-
    14/h4-7,12,15,17H,2-3,8-11H2,1H3/t12-,15-/m1/s1

    ChemDrug版权识别码:2631213435658021
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