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    Technical details about CAS 770-71-8, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 770-71-8

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 770-71-8, Adamantan-1-ylmethanol, 1-adamantylmethanol, 1-adamantane methanol, 1-(hydroxymethyl)adamantane, 3-(hydroxymethyl)adamantane
    Molecular Formula
    C11H18O
    Molecular Weight
    166.26  g/mol
    InChI Key
    MDVGOOIANLZFCP-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-adamantylmethanol
    2.1.2 InChI
    InChI=1S/C11H18O/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10,12H,1-7H2
    2.1.3 InChI Key
    MDVGOOIANLZFCP-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1C2CC3CC1CC(C2)(C3)CO
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 770-71-8

    2. Adamantan-1-ylmethanol

    3. 1-adamantylmethanol

    4. 1-adamantane Methanol

    5. 1-(hydroxymethyl)adamantane

    6. 3-(hydroxymethyl)adamantane

    7. Mfcd00074751

    8. Adamantane-1-methanol

    9. Tricyclo(3.3.1.1'3,7)dec-1-ylmethanol

    10. Hexahydro-2,5-methanopentalene-3a(1h)-methanol

    11. Tricyclo[3.3.1.13,7]decanemethanol

    12. (adamantan-1-yl)methanol

    13. 1-adamantanemethanol (6ci,7ci,8ci); (adamantan-1-yl)methanol; 1-(hydroxymethyl)adamantane; 1-adamantylcarbinol; 1-adamantylmethanol

    14. 1-hydroxymethyladamantane

    15. Adamantanemethanol

    16. 1-adamantanmethanol

    17. Einecs 212-225-3

    18. 1-adamantane-methanol

    19. Adamantyl Methylalcohol

    20. 1-adamantanyl Methanol

    21. Adamantan-1-yl-methanol

    22. Enamine_000905

    23. 1-adamantyl Methylalcohol

    24. 1-hydroxylmethyladamantane

    25. (1-hydroxymethyl)adamantane

    26. 1-adamantanemethanol, 99%

    27. Schembl236361

    28. Schembl17418023

    29. Bdbm36249

    30. Dtxsid20227818

    31. Hms1396j03

    32. Albb-013868

    33. Bcp04222

    34. Zinc1271106

    35. Geo-04333

    36. Stk385039

    37. Akos000100807

    38. Akos001033003

    39. Akos003619580

    40. Akos015908695

    41. Akos023552911

    42. Cs-w020560

    43. Pb13004

    44. Ac-16261

    45. As-14217

    46. Sy015615

    47. A9763

    48. Bb 0322388

    49. Ft-0607300

    50. H0420

    51. Tricyclo[3.3.1.1~3,7~]dec-1-ylmethanol

    52. En300-16797

    53. Tricyclo[3.3.1.1~3,7~]decane-1-methanol

    54. P10060

    55. Tricyclo[3.3.1.1(3,7)-]decane-1-methanol

    56. W-104329

    57. W-206071

    58. Z56782532

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 166.26 g/mol
    Molecular Formula C11H18O
    XLogP32.4
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count1
    Exact Mass166.135765193 g/mol
    Monoisotopic Mass166.135765193 g/mol
    Topological Polar Surface Area20.2 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity156
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1