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    CAS 83-33-0

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 83-33-0, Indan-1-one, 2,3-dihydro-1h-inden-1-one, Indanone, Alpha-indanone, 2,3-dihydroinden-1-one
    Molecular Formula
    C9H8O
    Molecular Weight
    132.16  g/mol
    InChI Key
    QNXSIUBBGPHDDE-UHFFFAOYSA-N
    FDA UNII
    V7021Y717I
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2,3-dihydroinden-1-one
    2.1.2 InChI
    InChI=1S/C9H8O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2
    2.1.3 InChI Key
    QNXSIUBBGPHDDE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CC(=O)C2=CC=CC=C21
    2.2 Other Identifiers
    2.2.1 UNII
    V7021Y717I
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Indacrinic Acid

    2. Indacrinone

    3. Indanone

    4. Indanone, (+-)-isomer

    5. Indanone, (r)-isomer

    6. Indanone, (s)-isomer

    7. Indanone, Sodium Salt

    8. Mk 196

    9. Mk 286

    10. Mk-286

    2.3.2 Depositor-Supplied Synonyms

    1. 83-33-0

    2. Indan-1-one

    3. 2,3-dihydro-1h-inden-1-one

    4. Indanone

    5. Alpha-indanone

    6. 2,3-dihydroinden-1-one

    7. Alpha-hydrindone

    8. 1h-inden-1-one, 2,3-dihydro-

    9. 1-indone

    10. Hydrindone

    11. .alpha.-indanone

    12. .alpha.-hydrindone

    13. Mfcd00003785

    14. 2,3-dihydro-1-indenone

    15. Nsc-2581

    16. V7021y717i

    17. Indenone, Dihydro-

    18. 1-hydroindone

    19. Indanone (van)

    20. 1-hydrindone

    21. 1-oxohydrindene

    22. 1-ketohydrindene

    23. Indane-1-one

    24. Indanone (1)

    25. Indanone(1-)

    26. Nsc 2581

    27. Einecs 201-470-1

    28. Indanone-(1)

    29. Dihydro-inden-1-one

    30. 30286-23-8

    31. Ai3-11798

    32. Bmse000496

    33. 1h-indan-1-one

    34. 2,3-dihydro-inden-1-one

    35. Indan-1-one (1-indanone)

    36. Schembl24746

    37. 1-oxobenzocyclopentane

    38. Schembl3694431

    39. Dtxsid1058892

    40. Unii-v7021y717i

    41. Chebi:17404

    42. Amy3674

    43. Nsc2581

    44. Zinc897152

    45. Act07634

    46. Bcp19847

    47. S9346

    48. Stk290968

    49. Akos000119606

    50. Rasagiline Metabolite, Indanone

    51. Ac-2464

    52. Ccg-321650

    53. Cs-w004333

    54. Pb48801

    55. Ps-5770

    56. 1-indanone, Reagentplus(r), >=99%

    57. 1-indanone, Purum, >=98.0% (gc)

    58. Bp-12824

    59. Sy001380

    60. Db-019218

    61. 1-indanone, Vetec(tm) Reagent Grade, 98%

    62. Ft-0607937

    63. I0013

    64. C01504

    65. I-0700

    66. 003i785

    67. Ah-034/32845037

    68. Q15906439

    69. F0001-2126

    70. Z1250132257

    71. 1on

    2.4 Create Date
    2004-09-16
    3 Chemical and Physical Properties
    Molecular Weight 132.16 g/mol
    Molecular Formula C9H8O
    XLogP31.7
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass132.057514874 g/mol
    Monoisotopic Mass132.057514874 g/mol
    Topological Polar Surface Area17.1 Ų
    Heavy Atom Count10
    Formal Charge0
    Complexity151
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Diuretics

    Agents that promote the excretion of urine through their effects on kidney function. (See all compounds classified as Diuretics.)

    Uricosuric Agents

    Gout suppressants that act directly on the renal tubule to increase the excretion of uric acid, thus reducing its concentrations in plasma. (See all compounds classified as Uricosuric Agents.)