Cas no 1805577-07-4 (Ethyl 2-bromo-4-chloropyridine-6-acetate)

Ethyl 2-bromo-4-chloropyridine-6-acetate is a versatile halogenated pyridine derivative commonly used as an intermediate in pharmaceutical and agrochemical synthesis. Its distinct bromo- and chloro-substitutions enhance reactivity, facilitating selective cross-coupling reactions such as Suzuki or Negishi couplings. The ester functional group offers further derivatization potential, enabling modifications to the carboxylate moiety. This compound exhibits high purity and stability under standard storage conditions, making it suitable for complex multi-step syntheses. Its structural features are particularly valuable in constructing heterocyclic scaffolds for bioactive molecules, including kinase inhibitors and antimicrobial agents. Careful handling is recommended due to its halogenated nature.
Ethyl 2-bromo-4-chloropyridine-6-acetate structure
1805577-07-4 structure
Product Name:Ethyl 2-bromo-4-chloropyridine-6-acetate
CAS No:1805577-07-4
MF:C9H9BrClNO2
MW:278.530260801315
CID:4900232
Update Time:2025-05-27

Ethyl 2-bromo-4-chloropyridine-6-acetate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2-bromo-4-chloropyridine-6-acetate
    • Ethyl 2-(6-bromo-4-chloropyridin-2-yl)acetate
    • Inchi: 1S/C9H9BrClNO2/c1-2-14-9(13)5-7-3-6(11)4-8(10)12-7/h3-4H,2,5H2,1H3
    • InChI Key: ZKQAPXQSBWZDKS-UHFFFAOYSA-N
    • SMILES: BrC1=CC(=CC(CC(=O)OCC)=N1)Cl

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 203
  • XLogP3: 2.7
  • Topological Polar Surface Area: 39.2

Ethyl 2-bromo-4-chloropyridine-6-acetate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A029013996-250mg
Ethyl 2-bromo-4-chloropyridine-6-acetate
1805577-07-4 95%
250mg
$970.20 2022-04-01
Alichem
A029013996-1g
Ethyl 2-bromo-4-chloropyridine-6-acetate
1805577-07-4 95%
1g
$2,837.10 2022-04-01

Additional information on Ethyl 2-bromo-4-chloropyridine-6-acetate

Comprehensive Overview of Ethyl 2-bromo-4-chloropyridine-6-acetate (CAS No. 1805577-07-4)

Ethyl 2-bromo-4-chloropyridine-6-acetate (CAS No. 1805577-07-4) is a specialized organic compound widely utilized in pharmaceutical and agrochemical research. This compound belongs to the pyridine derivative family, characterized by its unique bromo and chloro substituents, which enhance its reactivity and applicability in synthetic chemistry. Its molecular structure, featuring an ethyl acetate moiety, makes it a versatile intermediate for constructing complex molecules. Researchers and industries value this compound for its role in developing novel active pharmaceutical ingredients (APIs) and crop protection agents.

The growing demand for pyridine-based intermediates like Ethyl 2-bromo-4-chloropyridine-6-acetate is driven by advancements in drug discovery and precision agriculture. With the rise of AI-driven molecular design and high-throughput screening, this compound has gained attention for its potential in optimizing structure-activity relationships (SAR). Its halogenated pyridine core is particularly valuable for cross-coupling reactions, such as Suzuki-Miyaura or Buchwald-Hartwig couplings, which are pivotal in modern medicinal chemistry.

From an environmental perspective, Ethyl 2-bromo-4-chloropyridine-6-acetate aligns with the trend toward sustainable synthesis. Laboratories are increasingly adopting green chemistry principles to minimize waste and energy consumption during its production. This compound’s stability under controlled conditions also makes it suitable for large-scale manufacturing, addressing the need for cost-effective chemical processes in the pharmaceutical sector.

In the context of intellectual property, CAS No. 1805577-07-4 has been referenced in patents related to anticancer agents and herbicides. Its structural motifs are frequently explored in fragment-based drug design, a hot topic in biotech innovation. Additionally, its compatibility with flow chemistry techniques positions it as a candidate for continuous production, a method gaining traction due to its efficiency and scalability.

For researchers seeking high-purity Ethyl 2-bromo-4-chloropyridine-6-acetate, analytical methods such as HPLC and NMR are critical for quality control. The compound’s spectral data (e.g., 1H/13C NMR) is often shared in open-access databases, supporting reproducible science. As the scientific community emphasizes data transparency, suppliers now provide detailed certificates of analysis (CoA) to meet regulatory standards like REACH and GMP.

Looking ahead, Ethyl 2-bromo-4-chloropyridine-6-acetate is poised to play a pivotal role in emerging fields like proteolysis-targeting chimeras (PROTACs) and agrochemical bioisosteres. Its adaptability to catalyzed reactions and compatibility with bioorthogonal chemistry further expand its utility. With the global fine chemicals market projected to grow, this compound remains a key asset for innovators addressing challenges in human health and food security.

Recommended suppliers
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Shanghai Pearlk Chemicals Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk