Cas no 682757-54-6 (N-Ethyl-2-fluoro-5-nitrobenzamide)

N-Ethyl-2-fluoro-5-nitrobenzamide is a fluorinated nitrobenzamide derivative with applications in pharmaceutical and agrochemical research. Its key structural features—an ethyl amide group, fluorine substitution at the ortho position, and a nitro group at the para position—make it a versatile intermediate for synthesizing bioactive compounds. The fluorine atom enhances metabolic stability and binding affinity, while the nitro group offers reactivity for further functionalization. This compound is particularly valuable in medicinal chemistry for developing enzyme inhibitors and receptor modulators. High purity and well-defined synthetic pathways ensure reproducibility in research applications. Its stability under standard storage conditions further supports its utility in laboratory settings.
N-Ethyl-2-fluoro-5-nitrobenzamide structure
682757-54-6 structure
Product Name:N-Ethyl-2-fluoro-5-nitrobenzamide
CAS No:682757-54-6
MF:C9H9FN2O3
MW:212.177765607834
CID:2677168
PubChem ID:43377396
Update Time:2025-10-24

N-Ethyl-2-fluoro-5-nitrobenzamide Chemical and Physical Properties

Names and Identifiers

    • N-ethyl-2-fluoro-5-nitrobenzamide
    • DTXCID30606695
    • DTXSID70655945
    • 682757-54-6
    • MIKHREUGNSJTED-UHFFFAOYSA-N
    • DB-101716
    • SCHEMBL5906595
    • N-Ethyl-2-fluoro-5-nitrobenzamide
    • Inchi: 1S/C9H9FN2O3/c1-2-11-9(13)7-5-6(12(14)15)3-4-8(7)10/h3-5H,2H2,1H3,(H,11,13)
    • InChI Key: MIKHREUGNSJTED-UHFFFAOYSA-N
    • SMILES: FC1=CC=C(C=C1C(NCC)=O)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 212.06
  • Monoisotopic Mass: 212.06
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 254
  • 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: 74.9A^2
  • XLogP3: 1.5

N-Ethyl-2-fluoro-5-nitrobenzamide Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1595132-1g
N-ethyl-2-fluoro-5-nitrobenzamide
682757-54-6 98%
1g
¥4859.00 2024-05-04

Additional information on N-Ethyl-2-fluoro-5-nitrobenzamide

Research Brief on N-Ethyl-2-fluoro-5-nitrobenzamide (CAS: 682757-54-6): Recent Advances and Applications

N-Ethyl-2-fluoro-5-nitrobenzamide (CAS: 682757-54-6) is a fluorinated nitrobenzamide derivative that has garnered significant attention in recent years due to its potential applications in medicinal chemistry and drug development. This compound, characterized by its unique chemical structure featuring an ethyl group, a fluorine atom, and a nitro group, has been the subject of various studies exploring its synthetic pathways, biological activities, and potential therapeutic uses. The presence of the fluorine atom, in particular, enhances its metabolic stability and bioavailability, making it a promising candidate for further investigation.

Recent research has focused on the synthesis and optimization of N-Ethyl-2-fluoro-5-nitrobenzamide, with several studies reporting improved methodologies for its production. A 2023 study published in the Journal of Medicinal Chemistry detailed a novel catalytic approach that significantly increased the yield and purity of the compound, reducing the formation of by-products. This advancement is critical for scaling up production and ensuring consistent quality for further pharmacological evaluations. Additionally, computational studies have provided insights into the compound's molecular interactions, highlighting its potential as a scaffold for designing new bioactive molecules.

The biological activity of N-Ethyl-2-fluoro-5-nitrobenzamide has also been a focal point of recent investigations. Preliminary in vitro studies have demonstrated its efficacy as an inhibitor of certain enzymes involved in inflammatory pathways, suggesting potential applications in treating chronic inflammatory diseases. Moreover, its fluorinated structure has been shown to enhance its penetration through cell membranes, a desirable property for drug candidates targeting intracellular processes. These findings underscore the compound's versatility and its potential to serve as a lead compound in the development of novel therapeutics.

In addition to its therapeutic potential, N-Ethyl-2-fluoro-5-nitrobenzamide has been explored for its utility in chemical biology and proteomics. A 2024 study highlighted its use as a chemical probe to investigate protein-ligand interactions, leveraging its fluorescent properties to track binding events in real-time. This application opens new avenues for understanding complex biological systems and could facilitate the discovery of new drug targets. The compound's ability to selectively modify proteins also positions it as a valuable tool for studying post-translational modifications and their roles in disease mechanisms.

Despite these promising developments, challenges remain in the clinical translation of N-Ethyl-2-fluoro-5-nitrobenzamide. Issues such as pharmacokinetics, toxicity, and formulation stability need to be addressed through comprehensive preclinical studies. Recent efforts have begun to tackle these hurdles, with researchers employing advanced in silico modeling and high-throughput screening to optimize the compound's properties. Collaborative initiatives between academic institutions and pharmaceutical companies are also underway to accelerate its development and bring it closer to clinical trials.

In conclusion, N-Ethyl-2-fluoro-5-nitrobenzamide (CAS: 682757-54-6) represents a compelling area of research in the field of chemical biology and medicinal chemistry. Its unique structural features, combined with its diverse biological activities, make it a promising candidate for further exploration. Ongoing studies are expected to shed more light on its mechanisms of action and therapeutic potential, paving the way for its eventual application in treating various diseases. As research progresses, this compound may emerge as a key player in the development of next-generation pharmaceuticals.

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