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    CAS 583-55-1

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    CAS 583-55-1
    Also known as: 583-55-1, 2-bromoiodobenzene, O-bromoiodobenzene, 2-bromo-iodobenzene, Benzene, 1-bromo-2-iodo-, 1-bromo-2-iodo-benzene
    Molecular Formula
    C6H4BrI
    Molecular Weight
    282.90  g/mol
    InChI Key
    OIRHKGBNGGSCGS-UHFFFAOYSA-N
    1 2D Structure

    CAS 583-55-1

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-bromo-2-iodobenzene
    2.1.2 InChI
    InChI=1S/C6H4BrI/c7-5-3-1-2-4-6(5)8/h1-4H
    2.1.3 InChI Key
    OIRHKGBNGGSCGS-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC=C(C(=C1)Br)I
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 583-55-1

    2. 2-bromoiodobenzene

    3. O-bromoiodobenzene

    4. 2-bromo-iodobenzene

    5. Benzene, 1-bromo-2-iodo-

    6. 1-bromo-2-iodo-benzene

    7. 533-55-1

    8. 2-bromo-1-iodobenzene

    9. Mfcd00001030

    10. Bromoiodobenzene

    11. Iodobromobenzene

    12. 2-iodobromobenzene

    13. Bromo Iodo Benzene

    14. O-bromoiodiobenzene

    15. 2-bromo Iodobenzene

    16. 2-bromoiodobenzene?

    17. Einecs 209-508-9

    18. 1-iodo-2-bromobenzene

    19. 1-bromo-2-iodo Benzene

    20. 1-iodo-2-bromo Benzene

    21. 2-bromo-1-iodo-benzene

    22. 2-bromoiodobenzene, 99%

    23. 1-bromanyl-2-iodanyl-benzene

    24. Schembl192991

    25. Dtxsid1060394

    26. Zinc407075

    27. Str09197

    28. Ac7857

    29. Akos005254307

    30. Cs-w008713

    31. Ol10151

    32. Sy005125

    33. Db-013828

    34. A8259

    35. Am20040778

    36. Ft-0611569

    37. A831845

    38. J-504397

    39. F0001-1521

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 282.90 g/mol
    Molecular Formula C6H4BrI
    XLogP33.7
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count0
    Rotatable Bond Count0
    Exact Mass281.85411 g/mol
    Monoisotopic Mass281.85411 g/mol
    Topological Polar Surface Area0 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity74.9
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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