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  • (+)-alpha-Pinene,()-alpha-Pinene,1R-(+)-a-pinene,alpha-Pinene(dextro),
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]
    (+)-alpha-Pinene
    ()-alpha-Pinene
    1R-(+)-a-pinene
    alpha-Pinene(dextro)
    ALPHA-PINENE
    (1R)-()-alpha-Pinene
    (1R,5R)-2-Pinene
    (1R,5R)-pin-2-ene
    P45680_ALDRICH
    (+)-Pin-2(3)-ene

    [Structure]
    (+)-alpha-Pinene,()-alpha-Pinene,1R-(+)-a-pinene,alpha-Pinene(dextro),

    [ Properties Computed from Structure]
    Molecular Weight136.23404 [g/mol]
    Molecular FormulaC10H16
    XLogP4.2
    H-Bond Donor0
    H-Bond Acceptor0
    Rotatable Bond Count0
    Exact Mass136.125201
    MonoIsotopic Mass136.125201
    Topological Polar Surface Area0
    Heavy Atom Count10
    Formal Charge0
    Complexity186
    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: (1R,5R)-4,7,7-trimethylbicyclo[3.1.1]hept-3-ene
    Canonical SMILES: CC1=CCC2CC1C2(C)C
    Isomeric SMILES: CC1=CC[C@@H]2C[C@H]1C2(C)C
    InChI: InChI=1/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,
    9-/m1/s1

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