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    22264-50-2

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 22264-50-2, 1-aminocyclobutane-1-carboxylic acid, 1-amino-cyclobutanecarboxylic acid, 1-aminocyclobutane carboxylic acid, 22264-16-0, 1-amino-1-cyclobutanecarboxylic acid
    Molecular Formula
    C5H9NO2
    Molecular Weight
    115.13  g/mol
    InChI Key
    FVTVMQPGKVHSEY-UHFFFAOYSA-N
    FDA UNII
    1K1PGC7J6Z
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-aminocyclobutane-1-carboxylic acid
    2.1.2 InChI
    InChI=1S/C5H9NO2/c6-5(4(7)8)2-1-3-5/h1-3,6H2,(H,7,8)
    2.1.3 InChI Key
    FVTVMQPGKVHSEY-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CC(C1)(C(=O)O)N
    2.2 Other Identifiers
    2.2.1 UNII
    1K1PGC7J6Z
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-aminocyclobutane-1-carboxylate

    2. 1-aminocyclobutanecarboxylic Acid, 11c-labeled

    3. 1-aminocyclobutanecarboxylic Acid, 14c-labeled

    2.3.2 Depositor-Supplied Synonyms

    1. 22264-50-2

    2. 1-aminocyclobutane-1-carboxylic Acid

    3. 1-amino-cyclobutanecarboxylic Acid

    4. 1-aminocyclobutane Carboxylic Acid

    5. 22264-16-0

    6. 1-amino-1-cyclobutanecarboxylic Acid

    7. Acbc

    8. Cyclobutanecarboxylic Acid, 1-amino-

    9. 1-aminocyclobutanecarboxylicacid

    10. 1-aminocyclobutanecarboxlic Acid

    11. C5h9no2

    12. Mfcd00661068

    13. 1k1pgc7j6z

    14. Chembl131244

    15. 117259-24-2

    16. Nsc-403363

    17. Nsc-403362

    18. Nsc 403363

    19. Cb 1700

    20. Brn 2802253

    21. Tocris-0258

    22. 1y1z

    23. Specplus_000653

    24. Spectrum2_001476

    25. Spectrum3_000743

    26. Spectrum4_001046

    27. Spectrum5_001835

    28. Unii-1k1pgc7j6z

    29. Schembl61734

    30. Bspbio_002326

    31. Kbiogr_001312

    32. 3-14-00-00843 (beilstein Handbook Reference)

    33. Divk1c_006749

    34. Spbio_001431

    35. Kbio1_001693

    36. Kbio3_001546

    37. Dtxsid60176811

    38. Chebi:190867

    39. 1-amino-1-cyclobutanecarboxylicacid

    40. Albb-010153

    41. Cs-d0209

    42. Bbl001782

    43. Bdbm50038160

    44. Ccg-39205

    45. Hb0100

    46. Nsc403363

    47. Stk330996

    48. 1-amino-1-cyclobutane Carboxylic Acid

    49. Akos005172352

    50. Ac-5714

    51. Pb32216

    52. Sb10822

    53. Ncgc00024518-01

    54. Ncgc00024518-02

    55. Ncgc00024518-03

    56. Hy-30006

    57. Pd071292

    58. Sy002606

    59. Ts-01591

    60. 1-amino-1-cyclobutanecarboxylic Acid, 97%

    61. Db-010842

    62. A4782

    63. Am20070607

    64. En300-93167

    65. Ab00053379-03

    66. A816068

    67. Sr-01000597721

    68. 1-amino-1-cyclobutane Carboxylic Acid Hydrochloride

    69. J-504194

    70. Q1147632

    71. Sr-01000597721-1

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 115.13 g/mol
    Molecular Formula C5H9NO2
    XLogP3-2.9
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area63.3
    Heavy Atom Count8
    Formal Charge0
    Complexity118
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1