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    CAS 20443-98-5

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    CAS 20443-98-5
    Also known as: 20443-98-5, 2-(bromomethyl)-1,3-dichlorobenzene, Alpha-bromo-2,6-dichlorotoluene, Benzene, 2-(bromomethyl)-1,3-dichloro-, 2,6-dichlorobenzylbromide, 1-bromomethyl-2,6-dichlorobenzene
    Molecular Formula
    C7H5BrCl2
    Molecular Weight
    239.92  g/mol
    InChI Key
    PDFGFQUSSYSWNI-UHFFFAOYSA-N
    FDA UNII
    MP9K6Y018H
    1 2D Structure

    CAS 20443-98-5

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-(bromomethyl)-1,3-dichlorobenzene
    2.1.2 InChI
    InChI=1S/C7H5BrCl2/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2
    2.1.3 InChI Key
    PDFGFQUSSYSWNI-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=C(C(=C1)Cl)CBr)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    MP9K6Y018H
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 20443-98-5

    2. 2-(bromomethyl)-1,3-dichlorobenzene

    3. Alpha-bromo-2,6-dichlorotoluene

    4. Benzene, 2-(bromomethyl)-1,3-dichloro-

    5. 2,6-dichlorobenzylbromide

    6. 1-bromomethyl-2,6-dichlorobenzene

    7. .alpha.-bromo-2,6-dichlorotoluene

    8. A-bromo-2,6-dichlorotoluene

    9. Mp9k6y018h

    10. Nsc-93898

    11. Einecs 243-827-4

    12. Nsc 93898

    13. Brn 0637351

    14. 2,6 Dichloro Benzyl Bromide

    15. Benzene, 2-(bromomethyl)-1,3-dichloro- (9ci)

    16. Mfcd00000577

    17. Toluene, Alpha-bromo-2,6-dichloro-

    18. Schembl9770

    19. Unii-mp9k6y018h

    20. 2, 6-dichlorobenzyl Bromide

    21. 4-05-00-00834 (beilstein Handbook Reference)

    22. 2,6-di Chloro Benzyl Bromide

    23. Dtxsid60174392

    24. 2,6-dichlorobenzyl Bromide, 97%

    25. 2-bromomethyl-1,3-dichlorobenzene

    26. Act00502

    27. Nsc93898

    28. Str03144

    29. Zinc1609561

    30. Stl280128

    31. 2-(brornomethyl)-1,3-dichlorobenzene

    32. Akos007929978

    33. 2-(bromomethyl)-1,3-dichloro-benzene

    34. Am84244

    35. Toluene, .alpha.-bromo-2,6-dichloro-

    36. 2-(bromomethyl)-1,3-dichlorobenzene #

    37. Ac-26185

    38. D1749

    39. Ft-0610602

    40. A22382

    41. W-107620

    42. F0001-0724

    43. (6-bromo-imidazo[1,2-a]pyridin-2-yl)-aceticacid

    44. Alpha-bromo-2,6-dichloro-toluen;2-(bromomethyl)-1,3-dichlorobenzene

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 239.92 g/mol
    Molecular Formula C7H5BrCl2
    XLogP33.7
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count0
    Rotatable Bond Count1
    Exact Mass237.89517 g/mol
    Monoisotopic Mass237.89517 g/mol
    Topological Polar Surface Area0 Ų
    Heavy Atom Count10
    Formal Charge0
    Complexity97.8
    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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