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    Chemistry

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    Also known as: 114772-54-2, 2-[4-(bromomethyl)phenyl]benzonitrile, 4'-(bromomethyl)-[1,1'-biphenyl]-2-carbonitrile, 2-cyano-4'-bromomethylbiphenyl, 4'-bromomethyl-2-biphenylcarbonitrile, 2-(4-bromo-methylphenyl) benzonitrile
    Molecular Formula
    C14H10BrN
    Molecular Weight
    272.14  g/mol
    InChI Key
    LFFIEVAMVPCZNA-UHFFFAOYSA-N
    FDA UNII
    UI5JR3K10F
    2-4-Bromo-Methylphenyl Benzonitrile
    1 2D Structure

    2-4-Bromo-Methylphenyl Benzonitrile

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[4-(bromomethyl)phenyl]benzonitrile
    2.1.2 InChI
    InChI=1S/C14H10BrN/c15-9-11-5-7-12(8-6-11)14-4-2-1-3-13(14)10-16/h1-8H,9H2
    2.1.3 InChI Key
    LFFIEVAMVPCZNA-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CBr
    2.2 Other Identifiers
    2.2.1 UNII
    UI5JR3K10F
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 114772-54-2

    2. 2-[4-(bromomethyl)phenyl]benzonitrile

    3. 4'-(bromomethyl)-[1,1'-biphenyl]-2-carbonitrile

    4. 2-cyano-4'-bromomethylbiphenyl

    5. 4'-bromomethyl-2-biphenylcarbonitrile

    6. 2-(4-bromo-methylphenyl) Benzonitrile

    7. 4'-bromomethylbiphenyl-2-carbonitrile

    8. 2'-cyano-4-bromomethylbiphenyl

    9. 4'-(bromomethyl)-2-cyanobiphenyl

    10. (bromomethylphenyl-4')-2 Benzonitrile

    11. 2-(4-bromomethylphenyl)benzonitrile

    12. Ui5jr3k10f

    13. 2'-cyano-4-bromomethyl Biphenyl

    14. [1,1'-biphenyl]-2-carbonitrile, 4'-(bromomethyl)-

    15. 4'-(bromomethyl)-1,1'-biphenyl-2-carbonitrile

    16. 4'-(bromomethyl)biphenyl-2-carbonitrile

    17. 4'-(bromomethyl)-biphenyl-2-carbonitrile

    18. 4'-bromomethyl-biphenyl-2-carbonitrile

    19. 4-(2-cyanophenyl)benzyl Bromide

    20. 4'-(bromomethyl)(1,1'-biphenyl)-2-carbonitrile

    21. 4'-(bromomethyl)[1,1'-biphenyl]-2-carbonitrile

    22. (1,1'-biphenyl)-2-carbonitrile, 4'-(bromomethyl)-

    23. 4-bromomethyl-2'-cyanobiphenyl

    24. Bmcb

    25. Sartan Bromo Biphenyl

    26. Schembl357

    27. Unii-ui5jr3k10f

    28. Ec 601-327-7

    29. 4-bromomethyl-2-cyanophenyl

    30. 4;-bromomethyl-2-cyanobiphenyl

    31. 4'-bromo Methyl-2-cyanobiphenyl

    32. 4'-bromomethyl-2-cyano Biphenyl

    33. 4'-bromomethyl-2-cyano-biphenyl

    34. 4-bromomethyl-2'-cyano-biphenyl

    35. Lffievamvpczna-uhfffaoysa-

    36. Dtxsid30363559

    37. 2-cyano-4'-(bromomethyl)biphenyl

    38. 4 -(2-cyanophenyl)benzyl Bromide

    39. 4'-bromo Methyl-2-cyano Biphenyl

    40. 4-(bromomethyl)-2'-cyanobiphenyl

    41. Bcp04511

    42. Zinc1420574

    43. Cx1154

    44. Mfcd00671503

    45. 4'-bromomethyl-2-cyanobiphenyl-[d4]

    46. Akos009116156

    47. (2'-cyanobiphenyl-4-yl)methyl Bromide

    48. 2'-(cyano)biphenyl-4-yl-methylbromide

    49. 2'-(cyano)biphenyl-4-ylmethyl Bromide

    50. Ac-6862

    51. Cs-w002659

    52. 4-bromomethyl-2'-cyano-1,1'-biphenyl

    53. 4'-bromomethyl-1,1'-biphenyl-2-nitrile

    54. As-11904

    55. Db-011313

    56. 2-(4'-bromomethylphenyl)benzonitrile

    57. 4'-bromomethyl-2-biphenylcarbonitrile, 97%

    58. Am20060853

    59. Ft-0616705

    60. Ft-0657182

    61. En300-26985

    62. 72b542

    63. 4'-(bromomethyl) [1,1'-biphenyl]-2-carbonitrile

    64. J-003132

    65. J-513655

    2.4 Create Date
    2005-07-11
    3 Chemical and Physical Properties
    Molecular Weight 272.14 g/mol
    Molecular Formula C14H10BrN
    XLogP33.8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count2
    Exact Mass270.99966 g/mol
    Monoisotopic Mass270.99966 g/mol
    Topological Polar Surface Area23.8 Ų
    Heavy Atom Count16
    Formal Charge0
    Complexity259
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    API Reference Price

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    07-Jul-2021
    16-Sep-2024
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