Cas no 52833-63-3 (Benzamide, 2-fluoro-N-methyl-)

Benzamide, 2-fluoro-N-methyl-, is a fluorinated aromatic amide derivative with potential applications in pharmaceutical and agrochemical research. The incorporation of a fluorine atom at the 2-position and a methyl group on the nitrogen enhances its metabolic stability and bioavailability, making it a valuable intermediate in drug discovery. Its structural features allow for selective interactions with biological targets, particularly in the development of kinase inhibitors and CNS-active compounds. The compound's well-defined synthetic route and high purity ensure reproducibility in research settings. Its physicochemical properties, including solubility and lipophilicity, can be finely tuned for specific applications, underscoring its versatility in medicinal chemistry.
Benzamide, 2-fluoro-N-methyl- structure
Benzamide, 2-fluoro-N-methyl- structure
Product Name:Benzamide, 2-fluoro-N-methyl-
CAS No:52833-63-3
MF:C8H8FNO
MW:153.153625488281
CID:1579402
PubChem ID:2425972
Update Time:2025-08-05

Benzamide, 2-fluoro-N-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzamide, 2-fluoro-N-methyl-
    • 2-Fluoro-N-methylbenzamide
    • CS-0141018
    • HMS2323A19
    • BS-50333
    • Z32016402
    • AKOS001051590
    • CHEMBL1386501
    • CCA83363
    • 2-fluoro-N-methyl-benzamide
    • 52833-63-3
    • SB76071
    • SCHEMBL255025
    • SY259469
    • MLS000570290
    • SMR000150327
    • MFCD01214098
    • MDL: MFCD01214098
    • Inchi: 1S/C8H8FNO/c1-10-8(11)6-4-2-3-5-7(6)9/h2-5H,1H3,(H,10,11)
    • InChI Key: NAGFMACWWJYORB-UHFFFAOYSA-N
    • SMILES: FC1C=CC=CC=1C(NC)=O

Computed Properties

  • Exact Mass: 153.05904
  • Monoisotopic Mass: 153.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 149
  • 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: 1.5
  • Topological Polar Surface Area: 29.1A^2

Experimental Properties

  • PSA: 29.1

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Benzamide, 2-fluoro-N-methyl- Related Literature

Additional information on Benzamide, 2-fluoro-N-methyl-

Comprehensive Overview of Benzamide, 2-fluoro-N-methyl- (CAS No. 52833-63-3): Properties, Applications, and Industry Insights

Benzamide, 2-fluoro-N-methyl- (CAS No. 52833-63-3) is a fluorinated aromatic compound with significant relevance in pharmaceutical and agrochemical research. This N-methylated benzamide derivative is characterized by its unique molecular structure, featuring a fluorine substituent at the 2-position of the benzene ring. The presence of both fluoro and methyl functional groups enhances its reactivity, making it a valuable intermediate in synthetic chemistry.

In recent years, the demand for fluorinated organic compounds like 2-fluoro-N-methylbenzamide has surged due to their applications in drug discovery. Researchers highlight its role in modulating bioavailability and metabolic stability—a critical factor in developing next-generation therapeutics. The compound’s CAS No. 52833-63-3 is frequently searched in academic databases, reflecting its importance in medicinal chemistry and material science.

The synthesis of Benzamide, 2-fluoro-N-methyl- typically involves amide coupling reactions or direct fluorination techniques. Advanced methods such as microwave-assisted synthesis have improved yield efficiency, addressing industry concerns about sustainable production. Environmental considerations are also pivotal; recent studies explore green chemistry approaches to reduce waste during its manufacture.

From an industrial perspective, 52833-63-3 is often discussed in forums focusing on high-value chemical intermediates. Its compatibility with cross-coupling reactions (e.g., Suzuki-Miyaura) makes it a versatile building block for heterocyclic compounds. These traits align with growing interest in tailored molecular architectures for electronic materials and bioconjugation technologies.

Analytical characterization of 2-fluoro-N-methylbenzamide relies on techniques like NMR spectroscopy and HPLC-MS. Purity thresholds (>98%) are critical for pharmaceutical applications, driving innovations in chromatographic separation. Regulatory guidelines emphasize rigorous impurity profiling, a topic frequently queried in QA/QC workflows.

Emerging trends link fluorinated benzamides to precision agriculture, where they serve as scaffolds for crop protection agents. This connection to sustainable farming solutions has amplified its visibility in agrochemical patents. Additionally, its low toxicity profile (when compared to halogenated analogs) positions it favorably in eco-friendly formulations.

In conclusion, Benzamide, 2-fluoro-N-methyl- (CAS 52833-63-3) exemplifies the intersection of structural innovation and applied chemistry. Its multifaceted roles—from drug development to advanced materials—underscore why it remains a focal point in both academic and industrial research. Future directions may explore its potential in bioimaging probes or catalysis, further expanding its scientific footprint.

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