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    CAS-1075-89-4

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 3,3-tetramethyleneglutarimide, 1075-89-4, 1,1-cyclopentanediacetimide, 8-azaspiro(4.5)decane-7,9-dione, Vvj9w0k7w1, 3-spirocyclopentaneglutarimide
    Molecular Formula
    C9H13NO2
    Molecular Weight
    167.20  g/mol
    InChI Key
    YRTHJMQKDCXPAY-UHFFFAOYSA-N
    FDA UNII
    VVJ9W0K7W1
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    8-azaspiro[4.5]decane-7,9-dione
    2.1.2 InChI
    InChI=1S/C9H13NO2/c11-7-5-9(3-1-2-4-9)6-8(12)10-7/h1-6H2,(H,10,11,12)
    2.1.3 InChI Key
    YRTHJMQKDCXPAY-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CCC2(C1)CC(=O)NC(=O)C2
    2.2 Other Identifiers
    2.2.1 UNII
    VVJ9W0K7W1
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 3,3-tetramethyleneglutarimide

    2.3.2 Depositor-Supplied Synonyms

    1. 3,3-tetramethyleneglutarimide

    2. 1075-89-4

    3. 1,1-cyclopentanediacetimide

    4. 8-azaspiro(4.5)decane-7,9-dione

    5. Vvj9w0k7w1

    6. 3-spirocyclopentaneglutarimide

    7. 4,4-tetramethyleneglutarimide

    8. 8-azaspiro[4,5]decane-7,9-dione

    9. Mfcd00023871

    10. Nsc-400092

    11. Azaspirodecanedione

    12. Nsc400092

    13. 8-aza-spiro[4.5]decane-7,9-dione

    14. Busperidone Impurity K

    15. Buspirone Ep Impurity K

    16. Unii-vvj9w0k7w1

    17. Ec 427-770-4

    18. Dsstox_cid_31405

    19. Dsstox_rid_97291

    20. Buspirone Related Compound K

    21. Dsstox_gsid_57616

    22. Schembl529832

    23. 3,3-tetramethyl Eneglutarimide

    24. 3,3-tetramethylene Glutarimide

    25. Chembl3560272

    26. Dtxsid1057616

    27. Amy3774

    28. Azaspiro[4.5]decane-7,9-dione

    29. Str09408

    30. Zinc4031903

    31. Tox21_113849

    32. 8-azaspiro [4,5]-decane7,9-dione

    33. Akos000639181

    34. Nsc 400092

    35. Sb42921

    36. 8-azaspiro[4.5]decane-7,9-dione #

    37. Ncgc00253730-01

    38. .beta.-spirocyclopentaneglutarimide

    39. Ac-28907

    40. Bp-12572

    41. Sy049426

    42. Cas-1075-89-4

    43. Cs-0077659

    44. Ft-0600260

    45. T1412

    46. Buspirone Related Compound K [usp-rs]

    47. F12721

    48. A895414

    49. Sr-01000944905

    50. Buspirone Related Compound K [usp Impurity]

    51. Q4832288

    52. Sr-01000944905-1

    53. Buspirone Hydrochloride Impurity K [ep Impurity]

    54. F0044-0024

    55. Z108563950

    56. 8-azaspiro[4.5]decane-7,9-dione; 4,4-tetramethyleneglutarimide; 1,1-cyclopentanediacetimide; 3-spirocyclopentaneglutarimide

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 167.20 g/mol
    Molecular Formula C9H13NO2
    XLogP31
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass167.094628657 g/mol
    Monoisotopic Mass167.094628657 g/mol
    Topological Polar Surface Area46.2 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity211
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1