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    CAS 702-82-9

    BUILDING BLOCK

    MARKET PLACE

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 3-aminoadamantan-1-ol, 702-82-9, 3-amino-1-hydroxyadamantane, 1-amino-3-adamantanol, (5r,7s)-3-aminoadamantan-1-ol, 3-amino-adamantanol
    Molecular Formula
    C10H17NO
    Molecular Weight
    167.25  g/mol
    InChI Key
    DWPIPTNBOVJYAD-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-aminoadamantan-1-ol
    2.1.2 InChI
    InChI=1S/C10H17NO/c11-9-2-7-1-8(3-9)5-10(12,4-7)6-9/h7-8,12H,1-6,11H2
    2.1.3 InChI Key
    DWPIPTNBOVJYAD-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1C2CC3(CC1CC(C2)(C3)O)N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 3-aminoadamantan-1-ol

    2. 702-82-9

    3. 3-amino-1-hydroxyadamantane

    4. 1-amino-3-adamantanol

    5. (5r,7s)-3-aminoadamantan-1-ol

    6. 3-amino-adamantanol

    7. 3-amino-1-adamantanol Hydrate

    8. 1-aminoadamantane-3-ol

    9. 3-hydroxy-1-aminoadamantane

    10. 1-amino-3-hydroxyadamantane

    11. Tricyclo[3.3.1.13,7]decan-1-ol, 3-amino-

    12. Mfcd01821204

    13. Cbdive_015882

    14. 3-hydroxyadamantane Amine

    15. Oprea1_650197

    16. Schembl301876

    17. Chembl1624488

    18. Dtxsid00349729

    19. Albb-014973

    20. Stk387549

    21. Akos000283819

    22. Akos016344511

    23. Cs-w016045

    24. Pb47584

    25. Ps-6215

    26. Sdccgmls-0042673.p002

    27. Sy003569

    28. Db-014233

    29. 3-aminotricyclo[3.3.1.13,7]decan-1-ol

    30. Am20070529

    31. Bb 0261502

    32. Ft-0652890

    33. 3-aminotricyclo[3.3.1.1~3,7~]decan-1-ol

    34. 3-hydroxytricyclo[3.3.1.13,7 ]decan-1-amine

    35. Ab00073968-01

    36. 3-hydroxytricyclo[3.3.1.13,7 ]decan- 1-amine

    37. A836825

    38. 3-amino-1-adamantanol; 3-amino-1-hydroxyadamantane

    39. Z1741981630

    40. Tricyclo[3.3.1.1~3,7~]decan-1-ol, 3-amino-, Hydrochloride

    41. N-benzyl-2-(6-morpholin-4-ylpyridin-3-yl)-1,3-thiazole-4-carboxamide

    2.3 Create Date
    2005-06-29
    3 Chemical and Physical Properties
    Molecular Weight 167.25 g/mol
    Molecular Formula C10H17NO
    XLogP30.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass167.131014166 g/mol
    Monoisotopic Mass167.131014166 g/mol
    Topological Polar Surface Area46.2 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity212
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count2
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1