Cas no 1152979-31-1 (5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid)

5-Chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid is a fluorinated pyrazole derivative with significant potential in pharmaceutical and agrochemical applications. Its structure features a trifluoromethyl group and a chloro substituent, enhancing its reactivity and binding affinity in target interactions. The presence of a 4-fluorophenyl moiety contributes to improved metabolic stability and lipophilicity, making it a valuable intermediate in drug discovery. This compound is particularly useful in the synthesis of bioactive molecules, including enzyme inhibitors and receptor modulators, due to its versatile carboxylic acid functionality. Its high purity and well-defined chemical properties ensure consistent performance in research and industrial processes.
5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid structure
1152979-31-1 structure
Product Name:5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid
CAS No:1152979-31-1
MF:C11H5ClF4N2O2
MW:308.616215467453
MDL:MFCD13656010
CID:4561088
Update Time:2025-11-02

5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid
    • MDL: MFCD13656010
    • Inchi: 1S/C11H5ClF4N2O2/c12-9-7(10(19)20)8(11(14,15)16)17-18(9)6-3-1-5(13)2-4-6/h1-4H,(H,19,20)
    • InChI Key: PCTHVBSBJVFGFD-UHFFFAOYSA-N
    • SMILES: N1(C2=CC=C(F)C=C2)C(Cl)=C(C(O)=O)C(C(F)(F)F)=N1

5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid Pricemore >>

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Additional information on 5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid

Comprehensive Overview of 5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid (CAS No. 1152979-31-1)

The compound 5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid (CAS No. 1152979-31-1) is a highly specialized pyrazole derivative with significant applications in pharmaceutical and agrochemical research. Its unique molecular structure, featuring a trifluoromethyl group and a fluorophenyl moiety, makes it a valuable intermediate in the synthesis of bioactive molecules. Researchers and industry professionals frequently search for this compound due to its potential in developing novel enzyme inhibitors and crop protection agents.

In recent years, the demand for fluorinated compounds like 5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid has surged, driven by their enhanced metabolic stability and bioavailability. This aligns with the growing interest in sustainable chemistry and green synthesis methods. The compound's CAS No. 1152979-31-1 is often queried in databases such as SciFinder and Reaxys, reflecting its relevance in drug discovery and material science.

The pyrazole core of this compound is a key scaffold in medicinal chemistry, known for its versatility in binding to biological targets. The presence of a carboxylic acid group further enhances its utility as a building block for peptide mimetics and metal-organic frameworks (MOFs). These properties make it a subject of interest in computational chemistry studies, where researchers explore its molecular docking potential.

From an industrial perspective, 5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid is often discussed in the context of patent literature and process optimization. Companies are increasingly focusing on cost-effective synthesis routes to meet the demands of high-throughput screening and commercial-scale production. This has led to innovations in catalytic fluorination and microwave-assisted reactions, which are frequently searched topics in academic and industrial circles.

Environmental and regulatory considerations also play a role in the compound's applications. Its low ecotoxicity profile and biodegradability potential are often highlighted in life cycle assessments (LCAs). As the chemical industry shifts toward safer alternatives, this compound is being evaluated for its compliance with REACH and other global regulatory standards.

In summary, 5-chloro-3-(trifluoromethyl)-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid (CAS No. 1152979-31-1) represents a critical intersection of pharmaceutical innovation, agrochemical development, and sustainable chemistry. Its multifaceted applications and research potential ensure its continued prominence in scientific literature and industrial workflows.

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