Cas no 76053-49-1 (Pyridine, 2-chloro-5-(3-fluorophenyl)-)

Pyridine, 2-chloro-5-(3-fluorophenyl)- structure
76053-49-1 structure
Product Name:Pyridine, 2-chloro-5-(3-fluorophenyl)-
CAS No:76053-49-1
MF:C11H7ClFN
MW:207.631385087967
CID:538433
PubChem ID:20296359
Update Time:2025-04-24

Pyridine, 2-chloro-5-(3-fluorophenyl)- Chemical and Physical Properties

Names and Identifiers

    • Pyridine, 2-chloro-5-(3-fluorophenyl)-
    • 2-chloro-5-(3-fluorophenyl)pyridine
    • LogP
    • SCHEMBL1743003
    • DTXSID10604770
    • 76053-49-1
    • ZLBVPKOQOJFUFX-UHFFFAOYSA-N
    • Inchi: 1S/C11H7ClFN/c12-11-5-4-9(7-14-11)8-2-1-3-10(13)6-8/h1-7H
    • InChI Key: ZLBVPKOQOJFUFX-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C=N1)C1C=CC=C(C=1)F

Computed Properties

  • Exact Mass: 207.0251051g/mol
  • Monoisotopic Mass: 207.0251051g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 188
  • 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: 3.5
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • Density: 1.265
  • Boiling Point: 314°C at 760 mmHg
  • Flash Point: 143.7°C
  • Refractive Index: 1.569

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Additional information on Pyridine, 2-chloro-5-(3-fluorophenyl)-

Pyridine, 2-chloro-5-(3-fluorophenyl)- (CAS No. 76053-49-1): Properties, Applications, and Market Insights

Pyridine, 2-chloro-5-(3-fluorophenyl)- (CAS No. 76053-49-1) is a specialized heterocyclic compound that has garnered significant attention in the fields of pharmaceuticals, agrochemicals, and material science. This compound, characterized by its unique molecular structure combining a pyridine ring with chloro and fluorophenyl substituents, exhibits remarkable chemical properties that make it valuable for various industrial and research applications.

The growing interest in 2-chloro-5-(3-fluorophenyl)pyridine is driven by its versatility as a building block in organic synthesis. Researchers and manufacturers are increasingly exploring its potential in developing novel pharmaceutical intermediates, particularly in the creation of targeted therapies for chronic diseases. Recent studies have highlighted its role in the synthesis of biologically active molecules, aligning with current trends in precision medicine and drug discovery.

From a chemical perspective, Pyridine, 2-chloro-5-(3-fluorophenyl)- demonstrates excellent thermal stability and solubility in common organic solvents, making it suitable for various catalytic reactions and cross-coupling processes. These properties have made it particularly valuable in palladium-catalyzed reactions, which are fundamental to modern organic synthesis methodologies. The presence of both chloro and fluoro substituents enhances its reactivity profile, allowing for selective functionalization at multiple positions on the aromatic system.

In the agrochemical industry, derivatives of 2-chloro-5-(3-fluorophenyl)pyridine have shown promise in the development of new-generation crop protection agents. With increasing global focus on sustainable agriculture and reduced environmental impact of farming practices, this compound has emerged as a key intermediate for creating more efficient and eco-friendly pesticides and herbicides. Its structural features contribute to improved bioavailability and target specificity in agricultural formulations.

The material science sector has also recognized the potential of Pyridine, 2-chloro-5-(3-fluorophenyl)- in the development of advanced functional materials. Its incorporation into coordination polymers and metal-organic frameworks (MOFs) has opened new possibilities for creating materials with tailored electronic properties and molecular recognition capabilities. These applications align with current research trends in energy storage and sensor technology.

Market analysis indicates steady growth in demand for 2-chloro-5-(3-fluorophenyl)pyridine, particularly from the Asia-Pacific region where pharmaceutical and agrochemical production is expanding rapidly. Manufacturers are investing in improved synthetic routes to enhance yield and purity while reducing production costs. The compound's supply chain has become more robust in recent years, with multiple suppliers now offering custom synthesis and scale-up services to meet diverse research and industrial needs.

Quality control remains a critical aspect of Pyridine, 2-chloro-5-(3-fluorophenyl)- production, with advanced analytical techniques such as HPLC, GC-MS, and NMR spectroscopy being employed to ensure product consistency. The compound typically appears as a white to off-white crystalline powder with high purity levels (>98%), meeting the stringent requirements of pharmaceutical-grade applications.

Recent innovations in green chemistry have led to the development of more sustainable production methods for 2-chloro-5-(3-fluorophenyl)pyridine. Researchers are exploring catalyst recycling systems and solvent-free reaction conditions to minimize environmental impact. These advancements respond to growing industry demands for eco-friendly synthesis and reduced carbon footprint in chemical manufacturing.

From a regulatory perspective, Pyridine, 2-chloro-5-(3-fluorophenyl)- is subject to standard chemical handling and storage guidelines. Proper personal protective equipment (PPE) should be used when handling the compound, and it should be stored in cool, dry conditions away from incompatible materials. While not classified as hazardous under normal handling conditions, appropriate risk assessment should always be conducted prior to use.

The future outlook for 2-chloro-5-(3-fluorophenyl)pyridine appears promising, with ongoing research exploring its potential in bioconjugation chemistry and drug delivery systems. As the pharmaceutical industry continues to focus on personalized medicine and targeted drug design, the demand for specialized building blocks like this compound is expected to grow. Additionally, its applications in electronic materials and catalysis may expand as new technologies emerge in these fields.

For researchers and industry professionals seeking information about Pyridine, 2-chloro-5-(3-fluorophenyl)-, several key questions are frequently addressed: What are the optimal storage conditions? What are the most efficient synthetic routes? How does its reactivity compare to similar pyridine derivatives? These queries reflect the practical considerations surrounding this valuable chemical intermediate in contemporary research and industrial applications.

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