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    Atipamezole Hydrochloride

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    2D Structure
    Also known as: 104075-48-1, Atipamezole hcl, Atipamezole (hydrochloride), 4-(2-ethyl-2,3-dihydro-1h-inden-2-yl)-1h-imidazole hydrochloride, Mpv-1248 hydrochloride, 1h-imidazole, 4-(2-ethyl-2,3-dihydro-1h-inden-2-yl)-, monohydrochloride
    Molecular Formula
    C14H17ClN2
    Molecular Weight
    248.75  g/mol
    InChI Key
    PCCVCJAQMHDWJY-UHFFFAOYSA-N
    FDA UNII
    2W4279571X
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole;hydrochloride
    2.1.2 InChI
    InChI=1S/C14H16N2.ClH/c1-2-14(13-9-15-10-16-13)7-11-5-3-4-6-12(11)8-14;/h3-6,9-10H,2,7-8H2,1H3,(H,15,16);1H
    2.1.3 InChI Key
    PCCVCJAQMHDWJY-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCC1(CC2=CC=CC=C2C1)C3=CN=CN3.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    2W4279571X
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 104075-48-1

    2. Atipamezole Hcl

    3. Atipamezole (hydrochloride)

    4. 4-(2-ethyl-2,3-dihydro-1h-inden-2-yl)-1h-imidazole Hydrochloride

    5. Mpv-1248 Hydrochloride

    6. 1h-imidazole, 4-(2-ethyl-2,3-dihydro-1h-inden-2-yl)-, Monohydrochloride

    7. 5-(2-ethyl-2,3-dihydro-1h-inden-2-yl)-1h-imidazole Hydrochloride

    8. Mfcd06407819

    9. 2w4279571x

    10. 104075-48-1 (hcl)

    11. 5-(2-ethyl-2,3-dihydro-1h-indene-2-yl)-1h-imidazole Hydrochloride

    12. 4-(2-ethyl-2-indanyl)imidazole Hydrochloride

    13. Ncgc00182707-02

    14. Unii-2w4279571x

    15. Atipamezolehydrochloride

    16. Mpv1248 Hydrochloride

    17. Mpv 1248 Hydrochloride

    18. Dsstox_cid_28509

    19. Dsstox_rid_82781

    20. Dsstox_gsid_48583

    21. Schembl203964

    22. Chembl2361649

    23. Dtxsid2048583

    24. 5-(2-ethyl-1,3-dihydroinden-2-yl)-1h-imidazole;hydrochloride

    25. Act08567

    26. Amy10903

    27. Bcp04113

    28. Tox21_112912

    29. S4649

    30. Atipamezole Hydrochloride [mi]

    31. Akos015918212

    32. Akos025401424

    33. Ac-1613

    34. Bcp9000339

    35. Ccg-266950

    36. Cs-3389

    37. Atipamezole Hydrochloride [mart.]

    38. As-66133

    39. Hy-12380

    40. Sy057281

    41. B7226

    42. Cas-104075-48-1

    43. Ft-0656606

    44. Atipamezole Hydrochloride [green Book]

    45. F20658

    46. 075a481

    47. 5-(2-ethyl-indan-2-yl)-1h-imidazole Hydrochloride

    48. J-504668

    49. Q27255684

    50. Atipamezole Hydrochloride 100 Microg/ml In Acetonitrile

    51. 4-(2-ethyl-1,3-dihydroinden-2-yl)-1h-imidazole;hydrochloride

    2.4 Create Date
    2007-02-08
    3 Chemical and Physical Properties
    Molecular Weight 248.75 g/mol
    Molecular Formula C14H17ClN2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count2
    Exact Mass248.1080262 g/mol
    Monoisotopic Mass248.1080262 g/mol
    Topological Polar Surface Area28.7 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity237
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2