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    CAS 707-37-9

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 3,5-dimethyladamantan-1-ol, 707-37-9, 1-hydroxy-3,5-dimethyladamantane, 1,3-dimethyl-5-hydroxyadamantane, 1,3-dimethyl-5-adamantanol, L7qmg2cgv9
    Molecular Formula
    C12H20O
    Molecular Weight
    180.29  g/mol
    InChI Key
    LBWCITVBZLTEKW-UHFFFAOYSA-N
    FDA UNII
    L7QMG2CGV9
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3,5-dimethyladamantan-1-ol
    2.1.2 InChI
    InChI=1S/C12H20O/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9,13H,3-8H2,1-2H3
    2.1.3 InChI Key
    LBWCITVBZLTEKW-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC12CC3CC(C1)(CC(C3)(C2)O)C
    2.2 Other Identifiers
    2.2.1 UNII
    L7QMG2CGV9
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 3,5-dimethyladamantan-1-ol

    2. 707-37-9

    3. 1-hydroxy-3,5-dimethyladamantane

    4. 1,3-dimethyl-5-hydroxyadamantane

    5. 1,3-dimethyl-5-adamantanol

    6. L7qmg2cgv9

    7. Nsc-102294

    8. Tricyclo[3.3.1.13,7]decan-1-ol, 3,5-dimethyl-

    9. 5,7-dimethyl-3-adamantanol

    10. 3,5-dimethyl-1-hydroxyadamantane

    11. Mfcd00074775

    12. Memantine Related Compound B [usp-rs]

    13. Memantine Related Compound B

    14. Tricyclo(3.3.1.13,7)decan-1-ol, 3,5-dimethyl-

    15. Nsc102294

    16. Unii-l7qmg2cgv9

    17. Dimethyladamantanol [usp]

    18. Schembl733948

    19. Dtxsid10295485

    20. 1-hydroxy-3,5-dimethyl Adamantane

    21. Albb-013874

    22. Amy18593

    23. Bcp17454

    24. Memantine Related Compound B [usp]

    25. Stl420421

    26. Akos001056991

    27. Akos016313890

    28. Cs-w016006

    29. Ac-14487

    30. As-15103

    31. Sy053229

    32. Db-003031

    33. D3697

    34. Ft-0667364

    35. A836978

    36. Ae-641/01642003

    37. 3,5-dimethyltricyclo[3.3.1.1~3,7~]decan-1-ol

    38. Memantine Related Compound B [usp Impurity]

    39. Z56852724

    40. Tricyclo[3.3.1.1~3,7~]decan-1-ol, 3,5-dimethyl-

    41. Memantine Related Compound B;3,5-dimethyladamantane-1-ol

    42. Tricyclo(3.3.1.1(sup 3,7))decan-1-ol, 3,5-dimethyl-

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 180.29 g/mol
    Molecular Formula C12H20O
    XLogP33.5
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass180.151415257 g/mol
    Monoisotopic Mass180.151415257 g/mol
    Topological Polar Surface Area20.2 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity240
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count2
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1