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    CAS 51997-51-4

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 51997-51-4, 4-(2,3-epoxypropoxy)carbazole, 4-glycidyloxycarbazole, 4-epoxypropanoxycarbazole, 4-oxiranylmethoxy-9h-carbazole, 4-(2-oxiranylmethoxy)-9h-carbazole
    Molecular Formula
    C15H13NO2
    Molecular Weight
    239.27  g/mol
    InChI Key
    SVWKIGRDISDRLO-UHFFFAOYSA-N
    FDA UNII
    VX4N43V2E1
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-(oxiran-2-ylmethoxy)-9H-carbazole
    2.1.2 InChI
    InChI=1S/C15H13NO2/c1-2-5-12-11(4-1)15-13(16-12)6-3-7-14(15)18-9-10-8-17-10/h1-7,10,16H,8-9H2
    2.1.3 InChI Key
    SVWKIGRDISDRLO-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1C(O1)COC2=CC=CC3=C2C4=CC=CC=C4N3
    2.2 Other Identifiers
    2.2.1 UNII
    VX4N43V2E1
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 51997-51-4

    2. 4-(2,3-epoxypropoxy)carbazole

    3. 4-glycidyloxycarbazole

    4. 4-epoxypropanoxycarbazole

    5. 4-oxiranylmethoxy-9h-carbazole

    6. 4-(2-oxiranylmethoxy)-9h-carbazole

    7. 4-(2,3-epoxypropoxy)-carbazole

    8. 9h-carbazole, 4-(oxiranylmethoxy)-

    9. Carvedilol Related Compound D

    10. Vx4n43v2e1

    11. Mfcd03411884

    12. 4-oxiranylmethoxy-carbazole

    13. Unii-vx4n43v2e1

    14. 4-(2-oxiranylmethoxy)-9h-carbazol

    15. (r)-4-(oxiran-2-ylmethoxy)-9h-carbazole

    16. 9h-carbazole, 4-(2-oxiranylmethoxy)-

    17. Ec 610-764-2

    18. Schembl619267

    19. Chembl3580714

    20. 4-(2,3-epoxy Propoxy)carbazole

    21. 4-(2,3-epoxypropoxy) Carbazole

    22. 4-(2,3-epoxypropoxy)carbazole?

    23. 4-(oxiranylmethoxy)-9h-carbazole

    24. Dtxsid401306928

    25. Amy40799

    26. Bcp32066

    27. Ac8014

    28. Mfcd04973598

    29. Akos008901363

    30. 4-(oxirane-2-ylmethoxy)-9h-carbazole

    31. Ac-1994

    32. Cs-w014145

    33. Ks-1021

    34. Sb37482

    35. Sy038288

    36. Sy284588

    37. Db-057554

    38. Db-057555

    39. Ft-0616497

    40. Ft-0616498

    41. Ft-0642294

    42. Ft-0642295

    43. G0296

    44. (+/-)-4-oxiranylmethoxy-9h-carbazole

    45. Carvedilol Related Compound D [usp-rs]

    46. 997e514

    47. A828878

    48. A845180

    49. Carvedilol Related Compound D [usp Impurity]

    50. J-513258

    51. Q27292066

    52. Carvedilol Related Impurity D;4-(2,3-epoxypropoxy)carbazole

    53. 4-(2-oxiranylmethoxy)-9h-carbazole, Pharmaceutical Impurity Standard

    54. Carvedilol Related Compound D, United States Pharmacopeia (usp) Reference Standard

    2.4 Create Date
    2005-09-18
    3 Chemical and Physical Properties
    Molecular Weight 239.27 g/mol
    Molecular Formula C15H13NO2
    XLogP33.5
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass239.094628657 g/mol
    Monoisotopic Mass239.094628657 g/mol
    Topological Polar Surface Area37.6 Ų
    Heavy Atom Count18
    Formal Charge0
    Complexity309
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1