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    Heptaminol

    ACTIVE PHARMA INGREDIENTS

    MARKET PLACE

    REF. STANDARDS & IMPURITIES

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    2D Structure
    Also known as: 543-15-7, 6-amino-2-methyl-2-heptanol hydrochloride, Cardiosintol, Cortensor, Heptylon, Isoktamil
    Molecular Formula
    C8H20ClNO
    Molecular Weight
    181.70  g/mol
    InChI Key
    JZNBMCOSOXIZJB-UHFFFAOYSA-N
    FDA UNII
    XB3RM40HIR
    An amino alcohol that has been used as a myocardial stimulant and vasodilator and to relieve bronchospasm. Its most common therapeutic use is in orthostatic hypotension. The mechanism of heptaminol's therapeutic actions is not well understood although it has been suggested to affect catecholamine release or calcium metabolism.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-amino-2-methylheptan-2-ol;hydrochloride
    2.1.2 InChI
    InChI=1S/C8H19NO.ClH/c1-7(9)5-4-6-8(2,3)10;/h7,10H,4-6,9H2,1-3H3;1H
    2.1.3 InChI Key
    JZNBMCOSOXIZJB-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(CCCC(C)(C)O)N.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    XB3RM40HIR
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Cardiomax

    2. Heptaminol

    2.3.2 Depositor-Supplied Synonyms

    1. 543-15-7

    2. 6-amino-2-methyl-2-heptanol Hydrochloride

    3. Cardiosintol

    4. Cortensor

    5. Heptylon

    6. Isoktamil

    7. Izoktamil

    8. Respirin

    9. Corasor

    10. Eoden

    11. Arcor Tropfen

    12. Heptamyl Hydrochloride

    13. Heptaminol (hydrochloride)

    14. Heptamyl

    15. 2-methyl-6-amino-2-heptanol Hydrochloride

    16. 2-heptanol, 6-amino-2-methyl-, Hydrochloride

    17. 6-methyl-2-amino-6-heptanol Hydrochloride

    18. Xb3rm40hir

    19. Nsc-758406

    20. 6-amino-2-methylheptan-2-ol Hydrochloride

    21. 6-amino-2-methylheptan-2-ol;hydrochloride

    22. Heptamyl Tropfen

    23. 2831rp

    24. Rp 2831

    25. Rp-2831

    26. Ncgc00095021-01

    27. Coreptil

    28. Delmiton

    29. Heptylon Tropfen

    30. Dsstox_cid_25891

    31. Dsstox_rid_81205

    32. Dsstox_gsid_45891

    33. Hept-a-myl Tropfen

    34. Heptaminol Hcl

    35. Ea-85

    36. Sr-01000872644

    37. Einecs 208-837-5

    38. Unii-xb3rm40hir

    39. R.p. 2831

    40. Prestwick_257

    41. 2-heptylamine, 6-hydroxy-6-methyl-, Hydrochloride

    42. Heptaminolhydrochlorid

    43. Hept-a-myl (tn)

    44. Cas-543-15-7

    45. 6-hydroxy-6-methyl-2-heptylamine Hydrochloride

    46. Schembl317122

    47. Spectrum1503218

    48. Chembl2107282

    49. Dtxsid9045891

    50. Hms1568c11

    51. Hms1922i21

    52. Pharmakon1600-01503218

    53. Hy-b1231

    54. Tox21_111391

    55. Ccg-39314

    56. Heptaminol Hydrochloride [mi]

    57. Mfcd00013015

    58. Nsc758406

    59. Akos024348835

    60. Tox21_111391_1

    61. Cs-4878

    62. Nsc 758406

    63. Heptaminol Hydrochloride [mart.]

    64. Heptaminol Hydrochloride [who-dd]

    65. Ncgc00095021-02

    66. Ncgc00178043-05

    67. Db-052535

    68. Ft-0669129

    69. D08038

    70. Heptaminol Hydrochloride [ep Monograph]

    71. 6-amino-2-methyl-heptan-2-ol Hydrochloride

    72. Sr-01000872644-1

    73. Sr-01000872644-2

    74. Q27293761

    75. 2-heptanol, 6-amino-2-methyl-, Hydrochloride (1:1)

    76. Heptaminol Hydrochloride, European Pharmacopoeia (ep) Reference Standard

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 181.70 g/mol
    Molecular Formula C8H20ClNO
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count4
    Exact Mass181.1233420 g/mol
    Monoisotopic Mass181.1233420 g/mol
    Topological Polar Surface Area46.2 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity91.3
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2