Cas no 647025-63-6 (Benzenamine, 2,4-dichloro-5-iodo-)

Benzenamine, 2,4-dichloro-5-iodo-, is a halogenated aniline derivative with significant utility in organic synthesis and pharmaceutical intermediates. Its distinct substitution pattern—incorporating chlorine and iodine atoms—enhances its reactivity, making it a valuable precursor in cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings. The electron-withdrawing effects of the halogens improve its electrophilic character, facilitating selective functionalization. This compound is particularly useful in the development of agrochemicals and bioactive molecules due to its structural versatility. High purity grades ensure consistent performance in research and industrial applications. Proper handling is advised due to potential sensitivity to light and moisture.
Benzenamine, 2,4-dichloro-5-iodo- structure
647025-63-6 structure
Product Name:Benzenamine, 2,4-dichloro-5-iodo-
CAS No:647025-63-6
MF:C6H4Cl2IN
MW:287.913131713867
MDL:MFCD28786669
CID:418097
PubChem ID:71379026
Update Time:2025-05-21

Benzenamine, 2,4-dichloro-5-iodo- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 2,4-dichloro-5-iodo-
    • 2,4-dichloro-5-iodoaniline
    • 2,4-Dichloro-5-iodo-phenylamine
    • 647025-63-6
    • MFCD28786669
    • E84087
    • BS-51126
    • SB82347
    • DTXSID40801619
    • MDL: MFCD28786669
    • Inchi: 1S/C6H4Cl2IN/c7-3-1-4(8)6(10)2-5(3)9/h1-2H,10H2
    • InChI Key: CQJRIAHSGLIPDW-UHFFFAOYSA-N
    • SMILES: IC1=C(C=C(C(=C1)N)Cl)Cl

Computed Properties

  • Exact Mass: 286.87622
  • Monoisotopic Mass: 286.87655g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 122
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.1
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • PSA: 26.02

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Additional information on Benzenamine, 2,4-dichloro-5-iodo-

Comprehensive Overview of Benzenamine, 2,4-dichloro-5-iodo- (CAS No. 647025-63-6)

Benzenamine, 2,4-dichloro-5-iodo- (CAS No. 647025-63-6) is a halogenated aniline derivative that has garnered significant attention in organic synthesis and pharmaceutical research. This compound, characterized by its unique iodo and dichloro substitutions, serves as a versatile intermediate in the development of agrochemicals, dyes, and specialty chemicals. Its molecular structure, featuring a benzene ring with strategic halogen placements, enables selective reactivity, making it invaluable for cross-coupling reactions and functional group transformations.

In recent years, the demand for halogenated aromatic compounds like Benzenamine, 2,4-dichloro-5-iodo- has surged due to their role in sustainable chemistry and green synthesis. Researchers are increasingly exploring eco-friendly methodologies, such as catalytic iodination and solvent-free reactions, to produce such intermediates with minimal environmental impact. This aligns with global trends emphasizing circular economy principles and reduced carbon footprints in chemical manufacturing.

The compound’s CAS No. 647025-63-6 is frequently searched in databases like SciFinder and Reaxys, reflecting its relevance in drug discovery and material science. Its iodine moiety, in particular, facilitates applications in radiolabeling and imaging agents, addressing growing interest in diagnostic tools and targeted therapies. Users often query its synthetic routes, safety data, and supplier availability, underscoring its industrial and academic utility.

From a technical perspective, Benzenamine, 2,4-dichloro-5-iodo- exhibits notable stability under standard conditions, though storage recommendations typically advise protection from light and moisture to preserve integrity. Analytical techniques such as HPLC, NMR, and mass spectrometry are employed to verify purity, a critical factor for end-users in high-value applications. Regulatory compliance, including REACH and FDA guidelines, further influences its commercial adoption.

Emerging discussions in online forums and research publications highlight the compound’s potential in catalysis and nanotechnology. For instance, its halogen bonds are exploited in designing supramolecular architectures, a hot topic in advanced materials. Such interdisciplinary applications resonate with search trends linking halogenated compounds to innovative technologies.

In summary, Benzenamine, 2,4-dichloro-5-iodo- (CAS No. 647025-63-6) represents a pivotal building block in modern chemistry. Its adaptability to diverse synthetic pathways and alignment with sustainability goals ensures continued relevance. As industries prioritize efficiency and environmental responsibility, this compound is poised to remain a focal point in both research and commercial spheres.

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