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    CAS-67914-60-7

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 67914-60-7, 4-(1-acetylpiperazin-4-yl)phenol, 1-(4-(4-hydroxyphenyl)piperazin-1-yl)ethanone, 1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone, N-acetyl-4-(4-hydroxyphenyl)piperazine, 4-(4-acetylpiperazin-4-yl)phenol
    Molecular Formula
    C12H16N2O2
    Molecular Weight
    220.27  g/mol
    InChI Key
    AGVNLFCRZULMKK-UHFFFAOYSA-N
    FDA UNII
    YH9GD5K5NY
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone
    2.1.2 InChI
    InChI=1S/C12H16N2O2/c1-10(15)13-6-8-14(9-7-13)11-2-4-12(16)5-3-11/h2-5,16H,6-9H2,1H3
    2.1.3 InChI Key
    AGVNLFCRZULMKK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(=O)N1CCN(CC1)C2=CC=C(C=C2)O
    2.2 Other Identifiers
    2.2.1 UNII
    YH9GD5K5NY
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-(4-(4-hydroxyphenyl)piperazin-1-yl)ethanone

    2.3.2 Depositor-Supplied Synonyms

    1. 67914-60-7

    2. 4-(1-acetylpiperazin-4-yl)phenol

    3. 1-(4-(4-hydroxyphenyl)piperazin-1-yl)ethanone

    4. 1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone

    5. N-acetyl-4-(4-hydroxyphenyl)piperazine

    6. 4-(4-acetylpiperazin-4-yl)phenol

    7. Piperazine, 1-acetyl-4-(4-hydroxyphenyl)-

    8. Yh9gd5k5ny

    9. 1-acetyl-4-(4-hydroxylphenyl)piperazine

    10. 1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethan-1-one

    11. 4-(4-acetyl-1-piperazinyl)phenol

    12. 1-(4-(4-hydroxyphenyl)piperazin-1-yl)ethan-1-one

    13. Mfcd00044905

    14. 1-acetyl-4-(4-hydroxyphenyl)-piperazine

    15. Einecs 267-744-8

    16. Unii-yh9gd5k5ny

    17. Dsstox_cid_31593

    18. Dsstox_rid_97477

    19. Dsstox_gsid_57804

    20. Oprea1_786576

    21. 4-(4-acetylpiperazino)phenol

    22. Chembl202608

    23. Schembl1128293

    24. Dtxsid3057804

    25. Amy3594

    26. 4-(4-acetyl-1-piperazino)phenol

    27. Zinc105363

    28. 4-(4-acetylpiperazin-1-yl)phenol

    29. Tox21_113834

    30. Stk428757

    31. Akos000120546

    32. Cs-w014753

    33. Fs-4259

    34. Sdccgmls-0066236.p001

    35. 4-(4-hydroxyphenyl)-1-acetylpiperazine

    36. 4-acetyl-1-(4-hydroxyphenyl)piperazine

    37. Ncgc00253715-01

    38. 1-acetyl-4-(4'-hydroxyphenyl)piperazine

    39. 1-acetyl-4-(4-hydroxyphenyl) Piperazine

    40. 1-acetyl-4-(4-hydroxyphenyl)-piperizine

    41. 4-(4-hydroxy-phenyl)-1-acetylpiperazine

    42. Ac-11753

    43. 1-acetyl-4-(4-hydroxyl Phenyl) Piperazine

    44. Cas-67914-60-7

    45. Ft-0607282

    46. 1-acetyl-4-(4-hydroxyphenyl)piperazine, 98%

    47. 1-acetyl-4-(4-hydroxyphenyl)piperazine-[d8]

    48. E70355

    49. 1-[4-(4-hydroxyphenyl)-piperazin-1-yl]-ethanone

    50. A835934

    51. Ethanone,1-[4-(3-hydroxyphenyl)-1-piperazinyl]-

    52. Sr-01000944777

    53. Ethanone, 1-[4-(3-hydroxyphenyl)-1-piperazinyl]-

    54. Sr-01000944777-1

    55. W-104695

    56. Q27455472

    57. Z28269747

    58. 1-(4-(4-hydroxyphenyl)-1-piperazinyl)ethanone

    59. F0001-1784

    60. Ethanone, 1-(4-(4-hydroxyphenyl)-1-piperazinyl)-

    61. 4-(4-tert-butylphenyl)-2-(1-methylindol-3-yl)-4-oxo-butanoic Acid

    2.4 Create Date
    2005-07-08
    3 Chemical and Physical Properties
    Molecular Weight 220.27 g/mol
    Molecular Formula C12H16N2O2
    XLogP31
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass220.121177757 g/mol
    Monoisotopic Mass220.121177757 g/mol
    Topological Polar Surface Area43.8 Ų
    Heavy Atom Count16
    Formal Charge0
    Complexity241
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1