Cas no 204930-37-0 (5-Bromo-1,3-dichloro-2-methylbenzene)

5-Bromo-1,3-dichloro-2-methylbenzene is a halogenated aromatic compound with the molecular formula C?H?BrCl?. Its structure features bromine and chlorine substituents on a methyl-substituted benzene ring, making it a versatile intermediate in organic synthesis. The compound is particularly useful in cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings, due to the reactivity of its halogen groups. The methyl group enhances steric and electronic effects, influencing regioselectivity in further functionalization. This compound is valued for its stability, predictable reactivity, and utility in pharmaceutical and agrochemical research. Proper handling is required due to its halogenated nature, ensuring safety in laboratory environments.
5-Bromo-1,3-dichloro-2-methylbenzene structure
204930-37-0 structure
Product Name:5-Bromo-1,3-dichloro-2-methylbenzene
CAS No:204930-37-0
MF:C7H5BrCl2
MW:239.924599409103
MDL:MFCD11227146
CID:1024395
Update Time:2025-06-09

5-Bromo-1,3-dichloro-2-methylbenzene Chemical and Physical Properties

Names and Identifiers

    • 5-Bromo-1,3-dichloro-2-methylbenzene
    • 5-?Bromo-?1,?3-?dichloro-?2-?methylbenzene
    • 4-BROMO-2,6-DICHLOROTOLUENE
    • AC1LD2AA
    • AK-94392
    • ANW-44028
    • CTK8B4142
    • KSC914C4F
    • SureCN1751110
    • benzene, 5-bromo-1,3-dichloro-2-methyl-
    • LEXOYLCPBCBPJT-UHFFFAOYSA-N
    • CL8835
    • 0519AB
    • BC005236
    • AB0051435
    • ST24044359
    • MDL: MFCD11227146
    • Inchi: 1S/C7H5BrCl2/c1-4-6(9)2-5(8)3-7(4)10/h2-3H,1H3
    • InChI Key: LEXOYLCPBCBPJT-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(C)=C(C=1)Cl)Cl

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 106
  • Topological Polar Surface Area: 0

5-Bromo-1,3-dichloro-2-methylbenzene Pricemore >>

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Additional information on 5-Bromo-1,3-dichloro-2-methylbenzene

Comprehensive Guide to 5-Bromo-1,3-dichloro-2-methylbenzene (CAS No. 204930-37-0): Properties, Applications, and Industry Insights

5-Bromo-1,3-dichloro-2-methylbenzene (CAS No. 204930-37-0) is a halogenated aromatic compound widely utilized in organic synthesis and specialty chemical manufacturing. With the increasing demand for halogenated intermediates in pharmaceuticals, agrochemicals, and material science, this compound has garnered significant attention due to its unique reactivity and structural versatility. Its molecular formula, C7H5BrCl2, highlights the presence of bromine and chlorine substituents, which enhance its utility in cross-coupling reactions and functional group transformations.

In recent years, the surge in sustainable chemistry and green synthesis has driven researchers to explore efficient methods for producing halogenated compounds like 5-Bromo-1,3-dichloro-2-methylbenzene. Questions such as "How to optimize the synthesis of bromo-chloro aromatics?" or "What are the applications of halogenated methylbenzenes in drug discovery?" reflect growing industry interest. This compound’s electron-withdrawing properties make it a valuable building block for designing high-performance materials, including liquid crystals and polymer additives.

The physicochemical properties of CAS No. 204930-37-0 include a molecular weight of 240.93 g/mol, a melting point range of 45–50°C, and limited solubility in polar solvents. These traits align with its use in Pd-catalyzed reactions, such as Suzuki-Miyaura or Buchwald-Hartwig couplings, which are pivotal for constructing complex molecules. Analysts note a rising trend in searches for "bromo-chloro benzene derivatives" and "methylbenzene synthesis techniques," underscoring its relevance in R&D.

From an industrial perspective, 5-Bromo-1,3-dichloro-2-methylbenzene serves as a precursor for advanced intermediates in crop protection chemicals and electronic materials. Its stability under acidic conditions and compatibility with microwave-assisted chemistry further broaden its applications. Innovations in catalytic halogenation have also improved its production efficiency, addressing environmental concerns tied to traditional methods.

In conclusion, CAS No. 204930-37-0 exemplifies the critical role of halogenated aromatics in modern chemistry. As industries prioritize atom-efficient processes and multifunctional reagents, this compound’s demand is projected to grow, particularly in sectors leveraging structure-activity relationship (SAR) studies. Future research may focus on reducing byproducts and enhancing its recyclability, aligning with circular economy principles.

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