Cas no 1369177-56-9 (5-fluoroisoquinoline-8-carboxylic acid)

5-Fluoroisoquinoline-8-carboxylic acid is a fluorinated heterocyclic compound featuring a carboxylic acid functional group at the 8-position and a fluorine substituent at the 5-position of the isoquinoline scaffold. This structure imparts unique reactivity and potential applications in medicinal chemistry and pharmaceutical research, particularly as a building block for drug discovery. The fluorine atom enhances metabolic stability and binding affinity, while the carboxylic acid group allows for further derivatization or conjugation. Its well-defined molecular framework makes it valuable for synthesizing bioactive molecules, including enzyme inhibitors or receptor modulators. The compound is typically characterized by high purity and consistent quality, ensuring reliability in research and development applications.
5-fluoroisoquinoline-8-carboxylic acid structure
1369177-56-9 structure
Product Name:5-fluoroisoquinoline-8-carboxylic acid
CAS No:1369177-56-9
MF:C10H6FNO2
MW:191.158545970917
MDL:MFCD26667638
CID:4594174
PubChem ID:82574718
Update Time:2025-11-03

5-fluoroisoquinoline-8-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 5-fluoroisoquinoline-8-carboxylic acid
    • MDL: MFCD26667638
    • Inchi: 1S/C10H6FNO2/c11-9-2-1-7(10(13)14)8-5-12-4-3-6(8)9/h1-5H,(H,13,14)
    • InChI Key: ZMLXSVJDCTXDNK-UHFFFAOYSA-N
    • SMILES: C1C2=C(C(F)=CC=C2C(O)=O)C=CN=1

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Additional information on 5-fluoroisoquinoline-8-carboxylic acid

Comprehensive Overview of 5-Fluoroisoquinoline-8-carboxylic Acid (CAS No. 1369177-56-9): Properties, Applications, and Research Insights

5-Fluoroisoquinoline-8-carboxylic acid (CAS No. 1369177-56-9) is a fluorinated derivative of isoquinoline, a heterocyclic compound with significant relevance in medicinal chemistry and material science. This compound, characterized by the presence of a fluorine atom at the 5-position and a carboxylic acid group at the 8-position, has garnered attention for its unique physicochemical properties and potential applications in drug discovery, agrochemicals, and advanced materials. Researchers and industry professionals frequently search for terms like "5-fluoroisoquinoline-8-carboxylic acid synthesis", "CAS 1369177-56-9 applications", and "fluorinated isoquinoline derivatives", reflecting its growing importance in synthetic and applied chemistry.

The molecular structure of 5-fluoroisoquinoline-8-carboxylic acid combines the aromaticity of the isoquinoline core with the electron-withdrawing effects of the fluorine substituent, making it a versatile building block for designing bioactive molecules. Recent studies highlight its role in the development of kinase inhibitors, a class of therapeutics targeting cancer and inflammatory diseases. With the rise of personalized medicine, queries such as "fluorinated heterocycles in drug design" and "isoquinoline-based pharmaceuticals" have surged, underscoring the compound's relevance in modern drug development pipelines.

From a synthetic perspective, CAS 1369177-56-9 is often synthesized via palladium-catalyzed cross-coupling reactions or nucleophilic aromatic substitution, methods frequently searched by organic chemists. Its carboxylic acid functionality allows for further derivatization, enabling the creation of amides, esters, and other derivatives with tailored properties. The compound's stability under physiological conditions also makes it a candidate for pro-drug development, a trending topic in pharmaceutical research.

Beyond pharmaceuticals, 5-fluoroisoquinoline-8-carboxylic acid finds utility in materials science, particularly in the design of organic electronic materials and metal-organic frameworks (MOFs). Its ability to coordinate with metal ions and participate in π-π stacking interactions has led to explorations in luminescent materials and sensors. Searches for "fluorinated MOF linkers" and "isoquinoline-based sensors" align with these applications, reflecting interdisciplinary interest.

Environmental and regulatory considerations are also critical when discussing CAS 1369177-56-9. While not classified as hazardous, its handling requires standard laboratory precautions. The compound's biodegradability and ecotoxicity profiles are subjects of ongoing research, addressing queries like "green chemistry fluorinated compounds" and "sustainable heterocyclic synthesis". These topics resonate with the global push toward environmentally friendly chemical processes.

In summary, 5-fluoroisoquinoline-8-carboxylic acid (CAS No. 1369177-56-9) represents a multifaceted compound with broad applicability across life sciences and materials engineering. Its structural features, synthetic accessibility, and functional versatility position it as a valuable asset in addressing contemporary challenges in drug discovery, advanced materials, and sustainable chemistry. As research progresses, this compound is poised to play an even greater role in innovation-driven industries.

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