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    Technical details about CAS 941-37-7, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 941-37-7

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    2D Structure
    1. Also known as: 941-37-7, 1-bromo-3,5-dimethyl-adamantane, Memantine impurity d, Se68kq68t1, 3,5-dimethyl-1-bromoadamantane, 1-bromo-3,5-dimethyltricyclo[3.3.1.13,7]decane
    Molecular Formula
    C12H19Br
    Molecular Weight
    243.18  g/mol
    InChI Key
    QUCXLVDIVQWYJR-UHFFFAOYSA-N
    FDA UNII
    SE68KQ68T1
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-bromo-3,5-dimethyladamantane
    2.1.2 InChI
    InChI=1S/C12H19Br/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8H2,1-2H3
    2.1.3 InChI Key
    QUCXLVDIVQWYJR-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC12CC3CC(C1)(CC(C3)(C2)Br)C
    2.2 Other Identifiers
    2.2.1 UNII
    SE68KQ68T1
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 941-37-7

    2. 1-bromo-3,5-dimethyl-adamantane

    3. Memantine Impurity D

    4. Se68kq68t1

    5. 3,5-dimethyl-1-bromoadamantane

    6. 1-bromo-3,5-dimethyltricyclo[3.3.1.13,7]decane

    7. Mfcd00077197

    8. Nsc-102293

    9. Tricyclo[3.3.1.13,7]decane, 1-bromo-3,5-dimethyl-

    10. 1-bromo-3,5-dimethyltricyclo(3.3.1.13,7)decane

    11. 1,3-dimethyl-5-bromoadamantane

    12. Einecs 213-378-9

    13. Nsc102293

    14. 3,5-dimethyladamantylbromide

    15. Nciopen2_006758

    16. Unii-se68kq68t1

    17. Schembl732916

    18. 1-bromo-3,5dimethyladamantane

    19. Dtxsid00916495

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

    21. Act10950

    22. Albb-013818

    23. 1-?bromo-?3,5-?dimethyladamantane

    24. Stl453470

    25. Akos005174005

    26. Ac-5959

    27. Nsc 102293

    28. As-14308

    29. Sy042082

    30. Adamantane, 1-bromo-3,5-dimethyl-

    31. Db-019069

    32. Cs-0015436

    33. Ft-0633164

    34. Ft-0663716

    35. Memantine Related Compound D [usp-rs]

    36. 222131a

    37. A844841

    38. Memantine Related Compound D [usp Impurity]

    39. 1-bromo-3,5-dimethyltricyclo[3.3.1.1~3,7~]decane

    40. Tricyclo[3.3.1.1(3,7)-]decane, 1-bromo-3,5-dimethyl-

    41. Tricyclo[3.3.1.1~3,7~]decane, 1-bromo-3,5-dimethyl-

    42. Tricyclo(3.3.1.1(sup 3,7))decane, 1-bromo-3,5-dimethyl-

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 243.18 g/mol
    Molecular Formula C12H19Br
    XLogP35
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count0
    Rotatable Bond Count0
    Exact Mass242.06701 g/mol
    Monoisotopic Mass242.06701 g/mol
    Topological Polar Surface Area0 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
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