Cas no 1188412-99-8 (1,5-Difluoro-3-iodo-2-methyl-benzene)

1,5-Difluoro-3-iodo-2-methyl-benzene is a halogenated aromatic compound featuring fluorine and iodine substituents on a methyl-substituted benzene ring. Its distinct substitution pattern makes it a valuable intermediate in organic synthesis, particularly for cross-coupling reactions such as Suzuki or Sonogashira couplings, where the iodine moiety serves as a reactive site. The electron-withdrawing fluorine atoms enhance the reactivity of the ring, while the methyl group provides steric and electronic modulation. This compound is well-suited for applications in pharmaceuticals, agrochemicals, and materials science, offering precise control over molecular architecture. Its stability and defined reactivity profile ensure consistent performance in synthetic workflows.
1,5-Difluoro-3-iodo-2-methyl-benzene structure
1188412-99-8 structure
Product Name:1,5-Difluoro-3-iodo-2-methyl-benzene
CAS No:1188412-99-8
MF:C7H5F2I
MW:254.015881299973
CID:4685065
Update Time:2025-11-02

1,5-Difluoro-3-iodo-2-methyl-benzene Chemical and Physical Properties

Names and Identifiers

    • 1,5-Difluoro-3-iodo-2-methyl-benzene
    • 1,5-difluoro-3-iodo-2-methylbenzene
    • 2,4-Difluoro-6-iodotoluene
    • AKWRGQLQFYKOAV-UHFFFAOYSA-N
    • Inchi: 1S/C7H5F2I/c1-4-6(9)2-5(8)3-7(4)10/h2-3H,1H3
    • InChI Key: AKWRGQLQFYKOAV-UHFFFAOYSA-N
    • SMILES: IC1C=C(C=C(C=1C)F)F

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 118
  • Topological Polar Surface Area: 0

1,5-Difluoro-3-iodo-2-methyl-benzene Pricemore >>

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Additional information on 1,5-Difluoro-3-iodo-2-methyl-benzene

Comprehensive Guide to 1,5-Difluoro-3-iodo-2-methyl-benzene (CAS No. 1188412-99-8): Properties, Applications, and Market Insights

1,5-Difluoro-3-iodo-2-methyl-benzene (CAS No. 1188412-99-8) is a specialized aromatic compound that has garnered significant attention in the fields of organic synthesis, pharmaceuticals, and material science. This halogenated benzene derivative is characterized by its unique molecular structure, featuring fluorine and iodine substituents, which impart distinct reactivity and utility in various chemical processes. Researchers and industry professionals often search for "1,5-Difluoro-3-iodo-2-methyl-benzene synthesis" or "CAS 1188412-99-8 applications," highlighting its relevance in modern chemistry.

The compound's molecular formula, C7H5F2I, and its precise arrangement of functional groups make it a valuable intermediate in the synthesis of complex molecules. Its iodo group, in particular, is a hotspot for cross-coupling reactions, such as the Suzuki-Miyaura or Ullmann reactions, which are pivotal in drug discovery. Given the rising demand for "fluorinated building blocks" and "halogenated aromatic compounds," 1,5-Difluoro-3-iodo-2-methyl-benzene is increasingly sought after for its versatility.

One of the most compelling applications of 1,5-Difluoro-3-iodo-2-methyl-benzene lies in pharmaceutical research. The compound serves as a precursor for the development of bioactive molecules, including potential therapeutics for neurological disorders and oncology. Recent trends in "AI-driven drug discovery" have further amplified interest in such halogenated intermediates, as computational models predict their efficacy in target binding. Additionally, its fluorine atoms enhance metabolic stability, a critical factor in drug design.

In material science, 1,5-Difluoro-3-iodo-2-methyl-benzene is explored for its role in creating advanced polymers and liquid crystals. The "electronic effects of fluorine" in aromatic systems are a hot topic, particularly for applications in OLEDs (organic light-emitting diodes) and flexible electronics. Searches for "halogenated benzene derivatives for OLEDs" reflect this growing niche, where the compound's optoelectronic properties are under investigation.

The synthesis of 1,5-Difluoro-3-iodo-2-methyl-benzene typically involves halogenation and functional group manipulation of toluene derivatives. Industrial-scale production requires careful control of reaction conditions to ensure high purity, a key concern for buyers searching for "high-purity CAS 1188412-99-8." Environmental and safety considerations are also paramount, with "green chemistry approaches" gaining traction in its manufacturing processes.

Market dynamics for 1,5-Difluoro-3-iodo-2-methyl-benzene are influenced by the expanding pharmaceutical and electronics sectors. Regions like North America, Europe, and Asia-Pacific show robust demand, driven by R&D investments. Pricing trends for "halogenated benzene compounds" often correlate with the availability of raw materials, such as iodine and fluorine sources, making supply chain resilience a critical factor.

For researchers, handling 1,5-Difluoro-3-iodo-2-methyl-benzene requires adherence to standard laboratory safety protocols. While not classified as hazardous under normal conditions, proper storage (e.g., away from light and moisture) is essential to maintain stability. Queries like "storage conditions for iodobenzene derivatives" underscore the importance of these precautions.

Looking ahead, the compound's potential in "catalysis" and "supramolecular chemistry" is an emerging area of study. Its unique steric and electronic profile could unlock novel reaction pathways, aligning with the broader trend of "sustainable synthetic methods." Collaborations between academia and industry are likely to accelerate its adoption in cutting-edge applications.

In summary, 1,5-Difluoro-3-iodo-2-methyl-benzene (CAS No. 1188412-99-8) is a multifaceted compound with broad utility in science and technology. Its role in drug development, advanced materials, and green chemistry positions it as a key player in the evolving landscape of chemical innovation. As interest in "tailored halogenated aromatics" grows, this compound will remain a focal point for research and industrial applications.

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