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    Technical details about CAS 14818-35-0, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 14818-35-0

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    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

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    2D Structure
    1. Also known as: 14818-35-0, Ciclopirox related compound b, 6-cyclohexyl-4-methylpyran-2-one, 2h-pyran-2-one, 6-cyclohexyl-4-methyl-, 842dt6216z, Unii-842dt6216z
    Molecular Formula
    C12H16O2
    Molecular Weight
    192.25  g/mol
    InChI Key
    GPKRKAFTZYODFF-UHFFFAOYSA-N
    FDA UNII
    842DT6216Z
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-cyclohexyl-4-methylpyran-2-one
    2.1.2 InChI
    InChI=1S/C12H16O2/c1-9-7-11(14-12(13)8-9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3
    2.1.3 InChI Key
    GPKRKAFTZYODFF-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=CC(=O)OC(=C1)C2CCCCC2
    2.2 Other Identifiers
    2.2.1 UNII
    842DT6216Z
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 14818-35-0

    2. Ciclopirox Related Compound B

    3. 6-cyclohexyl-4-methylpyran-2-one

    4. 2h-pyran-2-one, 6-cyclohexyl-4-methyl-

    5. 842dt6216z

    6. Unii-842dt6216z

    7. Ciclopirox Olamine Impurity B [ep]

    8. Ciclopirox Impurity B

    9. Ciclopirox Olamine Specified Impurity B [ep]

    10. Schembl9765298

    11. 4-methyl-6-cyclohexyl-2-pyrone

    12. Dtxsid80163900

    13. Amy37287

    14. Mfcd09953433

    15. Zinc77050238

    16. 6-cyclohexyl-4-methyl Pyrone

    17. Akos006311314

    18. Ds-7241

    19. Ciclopirox Impurity B [ep Impurity]

    20. Cs-0153126

    21. Ft-0665361

    22. 6-cyclohexyl-4-methyl-2h-pyran-2-one-[d11]

    23. Ciclopirox Related Compound B [usp-rs]

    24. D87989

    25. A884373

    26. Ciclopirox Olamine Impurity B [ep Impurity]

    27. Q27269474

    2.4 Create Date
    2007-12-05
    3 Chemical and Physical Properties
    Molecular Weight 192.25 g/mol
    Molecular Formula C12H16O2
    XLogP32.9
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count1
    Exact Mass192.115029749 g/mol
    Monoisotopic Mass192.115029749 g/mol
    Topological Polar Surface Area26.3 Ų
    Heavy Atom Count14
    Formal Charge0
    Complexity293
    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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