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    Technical details about CAS 540-37-4, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 540-37-4

    BUILDING BLOCK

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    2D Structure
    Also known as: 540-37-4, P-iodoaniline, Benzenamine, 4-iodo-, 4-iodobenzenamine, Aniline, p-iodo-, P-aminophenyl iodide
    Molecular Formula
    C6H6IN
    Molecular Weight
    219.02  g/mol
    InChI Key
    VLVCDUSVTXIWGW-UHFFFAOYSA-N
    FDA UNII
    0BMK56397B
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-iodoaniline
    2.1.2 InChI
    InChI=1S/C6H6IN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2
    2.1.3 InChI Key
    VLVCDUSVTXIWGW-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=CC=C1N)I
    2.2 Other Identifiers
    2.2.1 UNII
    0BMK56397B
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. P-iodoaniline

    2.3.2 Depositor-Supplied Synonyms

    1. 540-37-4

    2. P-iodoaniline

    3. Benzenamine, 4-iodo-

    4. 4-iodobenzenamine

    5. Aniline, P-iodo-

    6. P-aminophenyl Iodide

    7. Aniline, 4-iodo-

    8. 4-iodo-aniline

    9. 4-iodophenylamine

    10. 4-iodobenzeneamine

    11. 4-iodo-phenylamine

    12. Mfcd00007848

    13. 0bmk56397b

    14. Nsc-9246

    15. 4-iodo-benzenamine

    16. Ccris 9122

    17. Nsc 9246

    18. Einecs 208-743-4

    19. Unii-0bmk56397b

    20. P-iodo-aniline

    21. P-iodo Aniline

    22. 4-iodanylaniline

    23. 4-iodoaniline?

    24. (4-iodophenyl)-amine

    25. Para-amino-iodo-benzene

    26. 4-iodoaniline, 98%

    27. Iodoaniline, P-

    28. P-aminoiodobenzene

    29. 1-amino-4-iodo-benzene

    30. Wln: Zr Di

    31. P-iodoaniline [mi]

    32. Schembl25837

    33. Chembl41790

    34. Dtxsid9060239

    35. Vlvcdusvtxiwgw-uhfffaoysa-

    36. Zinc13615

    37. 2-hydroxy-3-phenyl Propiophenone

    38. Nsc9246

    39. Act00167

    40. Bcp23259

    41. Stk358767

    42. Akos000119850

    43. Ac-5104

    44. Cs-w008946

    45. Ps-5431

    46. Bp-20434

    47. Sy013885

    48. 4-iodoaniline, Purum, >=97.0% (nt)

    49. Db-014488

    50. A7856

    51. Am20040674

    52. Ft-0618776

    53. I0048

    54. D70848

    55. Ab01003215-01

    56. A829920

    57. Q-103463

    58. Q27236574

    59. F0001-1412

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 219.02 g/mol
    Molecular Formula C6H6IN
    XLogP32.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass218.95450 g/mol
    Monoisotopic Mass218.95450 g/mol
    Topological Polar Surface Area26 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity66.9
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1