Cas no 1805138-10-6 (3-Bromo-4-chloro-2-methyl-5-nitropyridine)

3-Bromo-4-chloro-2-methyl-5-nitropyridine is a halogenated and nitrated pyridine derivative with significant utility in pharmaceutical and agrochemical research. Its multifunctional structure, featuring bromo, chloro, methyl, and nitro substituents, makes it a versatile intermediate for synthesizing complex heterocyclic compounds. The electron-withdrawing nitro group enhances reactivity in nucleophilic substitution reactions, while the halogen atoms provide sites for further functionalization. This compound is particularly valuable in the development of active pharmaceutical ingredients (APIs) and specialty chemicals due to its stability and predictable reactivity under controlled conditions. Its high purity and well-defined molecular structure ensure consistent performance in synthetic applications.
3-Bromo-4-chloro-2-methyl-5-nitropyridine structure
1805138-10-6 structure
Product Name:3-Bromo-4-chloro-2-methyl-5-nitropyridine
CAS No:1805138-10-6
MF:C6H4BrClN2O2
MW:251.465159416199
CID:4900204
Update Time:2025-05-24

3-Bromo-4-chloro-2-methyl-5-nitropyridine Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-4-chloro-2-methyl-5-nitropyridine
    • Inchi: 1S/C6H4BrClN2O2/c1-3-5(7)6(8)4(2-9-3)10(11)12/h2H,1H3
    • InChI Key: TXIXKIONLTTZET-UHFFFAOYSA-N
    • SMILES: BrC1=C(C(=CN=C1C)[N+](=O)[O-])Cl

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 187
  • XLogP3: 2.4
  • Topological Polar Surface Area: 58.7

3-Bromo-4-chloro-2-methyl-5-nitropyridine Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A029014076-250mg
3-Bromo-4-chloro-2-methyl-5-nitropyridine
1805138-10-6 95%
250mg
$940.80 2022-04-01
Alichem
A029014076-1g
3-Bromo-4-chloro-2-methyl-5-nitropyridine
1805138-10-6 95%
1g
$2,779.20 2022-04-01

Additional information on 3-Bromo-4-chloro-2-methyl-5-nitropyridine

Comprehensive Overview of 3-Bromo-4-chloro-2-methyl-5-nitropyridine (CAS No. 1805138-10-6)

3-Bromo-4-chloro-2-methyl-5-nitropyridine, with the CAS registry number 1805138-10-6, is a specialized heterocyclic compound that has garnered significant attention in pharmaceutical and agrochemical research. This compound belongs to the nitropyridine family, a class of compounds known for their versatile applications in medicinal chemistry and material science. The presence of multiple functional groups, including bromo, chloro, methyl, and nitro substituents, makes it a valuable intermediate for synthesizing more complex molecules. Researchers are particularly interested in its potential as a building block for drug discovery and crop protection agents, aligning with current trends in sustainable agriculture and precision medicine.

In recent years, the demand for 3-Bromo-4-chloro-2-methyl-5-nitropyridine has surged due to its role in developing small-molecule inhibitors and biologically active compounds. Its unique structural features allow for selective modifications, enabling scientists to explore its applications in kinase inhibition and antibacterial agents. The compound's CAS number 1805138-10-6 is frequently searched in academic databases and chemical supplier catalogs, reflecting its growing importance in industrial and academic laboratories. Additionally, its stability under various reaction conditions makes it a preferred choice for multistep synthetic routes.

The synthesis of 3-Bromo-4-chloro-2-methyl-5-nitropyridine typically involves halogenation and nitration reactions, followed by purification steps to achieve high purity. Advanced techniques such as HPLC and NMR spectroscopy are employed to characterize its molecular structure and ensure quality control. Given the increasing focus on green chemistry, researchers are also exploring eco-friendly synthetic pathways to produce this compound with minimal environmental impact. This aligns with the broader industry shift toward sustainable chemical manufacturing, a topic frequently discussed in scientific forums and SEO-optimized content.

From a commercial perspective, 3-Bromo-4-chloro-2-methyl-5-nitropyridine is available through specialized chemical suppliers who cater to the needs of pharmaceutical developers and agrochemical formulators. Its pricing and availability are often influenced by factors such as raw material costs and regulatory requirements. For those seeking detailed technical data, safety data sheets (SDS) and certificates of analysis (CoA) are essential resources. The compound's CAS no 1805138-10-6 serves as a unique identifier, ensuring accurate procurement and compliance with international standards.

Looking ahead, the potential applications of 3-Bromo-4-chloro-2-methyl-5-nitropyridine are expected to expand, particularly in the fields of personalized medicine and smart farming. Its compatibility with modern high-throughput screening techniques positions it as a key player in accelerating drug development pipelines. Furthermore, its relevance to AI-driven drug design and computational chemistry highlights its intersection with cutting-edge technologies. As the scientific community continues to uncover its full potential, this compound is poised to remain a focal point in innovative research and development.

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