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    Technical details about 2-Hydroxymetronidazole, learn more about the structure, uses, toxicity, action, side effects and more

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    2-Hydroxymetronidazole

    ANALYTICAL SOLUTION(s)

    PharmaCompass

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    2D Structure
    1. Also known as: 4812-40-2, Hydroxymetronidazole, Metronidazole-oh, Hydroxy metronidazole, 2-[2-(hydroxymethyl)-5-nitroimidazol-1-yl]ethanol, 2-hydroxymetronidazole
    Molecular Formula
    C6H9N3O4
    Molecular Weight
    187.15  g/mol
    InChI Key
    AEHPOYAOLCAMIU-UHFFFAOYSA-N
    FDA UNII
    7RUI9488IL
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[2-(hydroxymethyl)-5-nitroimidazol-1-yl]ethanol
    2.1.2 InChI
    InChI=1S/C6H9N3O4/c10-2-1-8-5(4-11)7-3-6(8)9(12)13/h3,10-11H,1-2,4H2
    2.1.3 InChI Key
    AEHPOYAOLCAMIU-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=C(N(C(=N1)CO)CCO)[N+](=O)[O-]
    2.2 Other Identifiers
    2.2.1 UNII
    7RUI9488IL
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-(hydroxymethyl)-5-nitro-1h-imidazole-1-ethanol

    2. 2-hydroxymethylmetronidazole

    3. 2-hydroxymetronidazole

    4. 20396 Rp

    5. Rp 20396

    6. Rp-20396

    2.3.2 Depositor-Supplied Synonyms

    1. 4812-40-2

    2. Hydroxymetronidazole

    3. Metronidazole-oh

    4. Hydroxy Metronidazole

    5. 2-[2-(hydroxymethyl)-5-nitroimidazol-1-yl]ethanol

    6. 2-hydroxymetronidazole

    7. 2-(hydroxymethyl)-5-nitro-1h-imidazole-1-ethanol

    8. Metronidazole-hydroxy

    9. 1h-imidazole-1-ethanol, 2-(hydroxymethyl)-5-nitro-

    10. 7rui9488il

    11. 1-(2-hydroxyethyl)-2-(hydroxymethyl)-5-nitroimidazole

    12. Metronidazole-hydroxy 100 Microg/ml In Acetonitrile

    13. 2-(2-(hydroxymethyl)-5-nitro-1h-imidazol-1-yl)ethanol

    14. 2-[2-(hydroxymethyl)-5-nitro-1h-imidazol-1-yl]ethan-1-ol

    15. 1-(2-hydroxyethyl)-2-hydroxymethyl-5-nitroimidazole (hydroxymetronidazole)

    16. Ccris 2148

    17. Brn 0883934

    18. Unii-7rui9488il

    19. 2-hydroxymethylmetronidazole

    20. Imidazole-1-ethanol, 2-hydroxymethyl-5-nitro-

    21. Imidazole-1-ethanol, 2-(hydroxymethyl)-5-nitro-

    22. 5-23-10-00558 (beilstein Handbook Reference)

    23. Chembl3544702

    24. Schembl10920908

    25. Dtxsid20197426

    26. Chebi:166538

    27. Zinc5116976

    28. Akos006283474

    29. 20396 Rp

    30. As-82869

    31. Da-27682

    32. Rp 20396

    33. Rp-20396

    34. Hy-136440

    35. Cs-0129416

    36. Ft-0669858

    37. Ft-0669859

    38. Metronidazole-hydroxy 100 Microg/ml In Methanol

    39. Q5955628

    40. 2-[2-(hydroxymethyl)-5-nitro-imidazol-1-yl]ethanol

    41. Metronidazole-oh, Vetranal(tm), Analytical Standard

    42. Hydroxyethyl)-2-hydroxymethyl-5-nitroimidazole, 1-(2-

    43. 1-(.beta.-hydroxyethyl) 2-hydroxymethyl-5-nitroimidazole

    44. Hydroxymetronidazole (1-(2-hydroxyethyl)-2-hydroxymethyl-5-nitroimidazole)

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 187.15 g/mol
    Molecular Formula C6H9N3O4
    XLogP3-1.3
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count3
    Exact Mass187.05930578 g/mol
    Monoisotopic Mass187.05930578 g/mol
    Topological Polar Surface Area104 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity183
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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