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    Technical details about CAS 529-28-2, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 529-28-2

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    PharmaCompass

    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

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    2D Structure
    1. Also known as: 1-iodo-2-methoxybenzene, 529-28-2, O-iodoanisole, Benzene, 1-iodo-2-methoxy-, Iodoanisole, 2-methoxyiodobenzene
    Molecular Formula
    C7H7IO
    Molecular Weight
    234.03  g/mol
    InChI Key
    DVQWNQBEUKXONL-UHFFFAOYSA-N
    FDA UNII
    75Y5532R8O
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-iodo-2-methoxybenzene
    2.1.2 InChI
    InChI=1S/C7H7IO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
    2.1.3 InChI Key
    DVQWNQBEUKXONL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC1=CC=CC=C1I
    2.2 Other Identifiers
    2.2.1 UNII
    75Y5532R8O
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 1-iodo-2-methoxybenzene

    2. 529-28-2

    3. O-iodoanisole

    4. Benzene, 1-iodo-2-methoxy-

    5. Iodoanisole

    6. 2-methoxyiodobenzene

    7. O-anisyl Iodide

    8. Anisole, O-iodo-

    9. 2-iodophenol Methyl Ether

    10. O-methoxyiodobenzene

    11. Mfcd00001039

    12. Nsc-9259

    13. 75y5532r8o

    14. 2-iodophenyl Methyl Ether

    15. 1-iodo-2-methoxy-benzene

    16. Iodanisol

    17. 2-iodoanisol

    18. Unii-75y5532r8o

    19. 2'-iodoanisole

    20. Nsc 9259

    21. Einecs 208-456-4

    22. 2-iodoanisole, 98%

    23. O-iodomethoxybenzene

    24. C03575

    25. O-iodoanisole [mi]

    26. 2-iodophenyl Methyl Ether; 2-methoxyiodobenzene

    27. O-methoxyphenyl Iodide

    28. 2-methoxyphenyl Iodide

    29. Schembl245025

    30. 2-methoxy-1-iodobenzene

    31. Dtxsid1060184

    32. Chebi:16355

    33. Nsc9259

    34. Zinc391100

    35. Act07812

    36. Str07301

    37. Akos009031638

    38. Am87037

    39. Cs-w009305

    40. Sb66474

    41. Ac-25985

    42. Bp-13158

    43. Sy017939

    44. Db-024110

    45. Ft-0612660

    46. I0382

    47. A19932

    48. N10126

    49. W-105786

    50. Q27101865

    51. F0001-1363

    2.4 Create Date
    2004-09-16
    3 Chemical and Physical Properties
    Molecular Weight 234.03 g/mol
    Molecular Formula C7H7IO
    XLogP32.8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count1
    Exact Mass233.95416 g/mol
    Monoisotopic Mass233.95416 g/mol
    Topological Polar Surface Area9.2 Ų
    Heavy Atom Count9
    Formal Charge0
    Complexity85
    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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