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    Technical details about CAS 1878-68-8, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 1878-68-8

    BUILDING BLOCK

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    2D Structure
    Also known as: 1878-68-8, 2-(4-bromophenyl)acetic acid, (4-bromophenyl)acetic acid, P-bromophenylacetic acid, 4-bromophenyl acetic acid, 4-bromobenzeneacetic acid
    Molecular Formula
    C8H7BrO2
    Molecular Weight
    215.04  g/mol
    InChI Key
    QOWSWEBLNVACCL-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-(4-bromophenyl)acetic acid
    2.1.2 InChI
    InChI=1S/C8H7BrO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
    2.1.3 InChI Key
    QOWSWEBLNVACCL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=CC=C1CC(=O)O)Br
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1878-68-8

    2. 2-(4-bromophenyl)acetic Acid

    3. (4-bromophenyl)acetic Acid

    4. P-bromophenylacetic Acid

    5. 4-bromophenyl Acetic Acid

    6. 4-bromobenzeneacetic Acid

    7. Benzeneacetic Acid, 4-bromo-

    8. (p-bromophenyl)acetic Acid

    9. 4-bromophenylaceticacid

    10. Mfcd00004342

    11. Acetic Acid, (p-bromophenyl)-

    12. 4-bromo-phenyl-acetic Acid

    13. P-bromphenylessigsaure

    14. P-bromphenylessigsaure [german]

    15. Acide P-bromophenylacetique [french]

    16. Einecs 217-523-7

    17. Nsc 14358

    18. Acide P-bromophenylacetique

    19. Brn 0972146

    20. 4bromophenylacetic Acid

    21. 4-bromo-phenylacetic Acid

    22. 4-bromophenyl-acetic Acid

    23. 4-bromo-benzeneacetic Acid

    24. 4-bromo Phenyl Acetic Acid

    25. 4-bromo-phenyl Acetic Acid

    26. (4-bromophenyl)-acetic Acid

    27. Schembl29257

    28. 3-09-00-02275 (beilstein Handbook Reference)

    29. 4-bromophenylacetic Acid Acid

    30. (4-bromo-phenyl)-acetic Acid

    31. Chebi:1790

    32. 4-bromophenylacetic Acid, 98%

    33. Dtxsid2062032

    34. Hms1788p11

    35. Zinc167159

    36. Act01177

    37. Cs-d0933

    38. Nsc14358

    39. Str02794

    40. Nsc-14358

    41. Stl061090

    42. Akos000150899

    43. Ab00367

    44. Ac-4183

    45. Am86716

    46. Ccg-255918

    47. Ps-4698

    48. Sy001685

    49. Ft-0617912

    50. A21790

    51. C03076

    52. P16509

    53. W-107764

    54. Q27105508

    55. F2191-0031

    56. (p-bromophenyl)-aceticaci;aceticacid,(p-bromophenyl)-;benzeneacetic Acid, 4-bromo-

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 215.04 g/mol
    Molecular Formula C8H7BrO2
    XLogP32.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass213.96294 g/mol
    Monoisotopic Mass213.96294 g/mol
    Topological Polar Surface Area37.3 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity139
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1