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    Chemistry

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    Also known as: 855398-57-1, 6-oxaspiro [4.5] decan-9-one, Mfcd19651152, Schembl614887, Jgpuwaqxclttbt-uhfffaoysa-n, Fjb39857
    Molecular Formula
    C9H14O2
    Molecular Weight
    154.21  g/mol
    InChI Key
    JGPUWAQXCLTTBT-UHFFFAOYSA-N
    CAS 855398-57-1
    1 2D Structure

    CAS 855398-57-1

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-oxaspiro[4.5]decan-9-one
    2.1.2 InChI
    InChI=1S/C9H14O2/c10-8-3-6-11-9(7-8)4-1-2-5-9/h1-7H2
    2.1.3 InChI Key
    JGPUWAQXCLTTBT-UHFFFAOYSA-N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 855398-57-1

    2. 6-oxaspiro [4.5] Decan-9-one

    3. Mfcd19651152

    4. Schembl614887

    5. Jgpuwaqxclttbt-uhfffaoysa-n

    6. Fjb39857

    7. Akos013423936

    8. Sb40626

    9. As-42848

    10. Da-35948

    11. Sy100094

    12. Cs-0050151

    13. En300-365937

    2.3 Create Date
    2012-10-23
    3 Chemical and Physical Properties
    Molecular Weight 154.21 g/mol
    Molecular Formula C9H14O2
    XLogP30.6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area26.3
    Heavy Atom Count11
    Formal Charge0
    Complexity168
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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