Cas no 301823-61-0 (Methyl 4-chloro-6-fluoroquinoline-2-carboxylate)

Methyl 4-chloro-6-fluoroquinoline-2-carboxylate is a fluorinated quinoline derivative with significant utility in pharmaceutical and agrochemical research. Its structure, featuring both chloro and fluoro substituents, enhances reactivity and selectivity, making it a valuable intermediate in the synthesis of bioactive compounds. The ester functional group at the 2-position allows for further derivatization, facilitating the development of novel quinolone-based therapeutics. This compound exhibits stability under standard handling conditions and demonstrates compatibility with various synthetic protocols. Its precise molecular architecture makes it particularly useful in medicinal chemistry for targeting bacterial and antiviral applications. High purity grades are available to ensure reproducibility in research and industrial processes.
Methyl 4-chloro-6-fluoroquinoline-2-carboxylate structure
301823-61-0 structure
Product Name:Methyl 4-chloro-6-fluoroquinoline-2-carboxylate
CAS No:301823-61-0
MF:C11H7ClFNO2
MW:239.630185365677
MDL:MFCD11855884
CID:839662
PubChem ID:46739216
Update Time:2025-06-15

Methyl 4-chloro-6-fluoroquinoline-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-chloro-6-fluoroquinoline-2-carboxylate
    • ACMC-209hdo
    • AG-E-98925
    • AK-94469
    • ANW-26794
    • CTK4G4620
    • KB-54338
    • SureCN3281931
    • 301823-61-0
    • METHYL4-CHLORO-6-FLUOROQUINOLINE-2-CARBOXYLATE
    • SCHEMBL3281931
    • DTXSID40674840
    • AKOS012682800
    • SB70298
    • MFCD11855884
    • CS-0084834
    • BS-27785
    • D74575
    • MDL: MFCD11855884
    • Inchi: 1S/C11H7ClFNO2/c1-16-11(15)10-5-8(12)7-4-6(13)2-3-9(7)14-10/h2-5H,1H3
    • InChI Key: CXAWNDWONHOZNO-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C(=O)OC)N=C2C=CC(=CC2=1)F

Computed Properties

  • Exact Mass: 239.01501
  • Monoisotopic Mass: 239.015
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 277
  • 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
  • Topological Polar Surface Area: 39.2A^2
  • XLogP3: 3.1

Experimental Properties

  • Density: 1.403
  • Boiling Point: 348.738 °C at 760 mmHg
  • Flash Point: 164.711 °C
  • PSA: 39.19

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Additional information on Methyl 4-chloro-6-fluoroquinoline-2-carboxylate

Comprehensive Overview of Methyl 4-chloro-6-fluoroquinoline-2-carboxylate (CAS No. 301823-61-0)

Methyl 4-chloro-6-fluoroquinoline-2-carboxylate (CAS No. 301823-61-0) is a highly specialized quinoline derivative that has garnered significant attention in pharmaceutical and agrochemical research. This compound, characterized by its unique chloro-fluoro substitution pattern, serves as a critical intermediate in the synthesis of bioactive molecules. Its molecular structure, featuring a methyl ester group at the 2-position, enhances its reactivity and versatility in organic transformations. Researchers are increasingly exploring its potential in drug discovery, particularly for targeting antibacterial and antifungal applications, aligning with the global demand for novel antimicrobial agents.

The growing interest in Methyl 4-chloro-6-fluoroquinoline-2-carboxylate is reflected in its frequent appearance in scientific literature and patent filings. Its CAS No. 301823-61-0 is often searched alongside terms like "quinoline synthesis," "fluoroquinolone precursors," and "heterocyclic building blocks," highlighting its relevance in modern chemistry. The compound’s chloro and fluoro substituents contribute to its electron-deficient nature, making it a valuable scaffold for designing enzyme inhibitors and receptor modulators. This aligns with current trends in precision medicine, where researchers seek tailored solutions for complex diseases.

In the context of green chemistry, Methyl 4-chloro-6-fluoroquinoline-2-carboxylate has been studied for its potential in sustainable synthesis routes. With the rise of environmentally friendly protocols, chemists are optimizing its production to minimize waste and energy consumption. Questions like "How to synthesize Methyl 4-chloro-6-fluoroquinoline-2-carboxylate efficiently?" or "What are the applications of fluorinated quinolines?" are commonly encountered in academic and industrial forums, underscoring its practical significance.

Another area of exploration for CAS No. 301823-61-0 is its role in material science. The quinoline core of this compound exhibits luminescent properties, making it a candidate for organic light-emitting diodes (OLEDs) and sensors. This interdisciplinary appeal bridges the gap between pharmaceuticals and advanced materials, addressing user queries such as "Can quinoline derivatives be used in optoelectronics?" or "What are the latest advances in fluorinated heterocycles?"

From a commercial standpoint, Methyl 4-chloro-6-fluoroquinoline-2-carboxylate is supplied by leading chemical manufacturers under stringent quality controls. Its purity and stability are critical for reproducible results in research, prompting frequent searches for "reliable suppliers of CAS 301823-61-0" and "analytical methods for quinoline derivatives." The compound’s spectroscopic data (e.g., NMR, HPLC) is also widely documented to aid in verification and application studies.

In summary, Methyl 4-chloro-6-fluoroquinoline-2-carboxylate (CAS No. 301823-61-0) stands at the intersection of innovation and utility. Its multifaceted applications—from drug development to functional materials—resonate with contemporary scientific priorities. As interest in fluorinated compounds and heterocyclic chemistry continues to surge, this compound remains a focal point for researchers aiming to address pressing challenges in health and technology.

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