Cas no 372-41-8 (5-fluorobenzene-1,3-diamine)

5-Fluorobenzene-1,3-diamine is a fluorinated aromatic diamine with the molecular formula C6H7FN2. This compound features a benzene ring substituted with a fluorine atom and two amino groups in the meta positions, making it a valuable intermediate in organic synthesis and pharmaceutical applications. Its electron-withdrawing fluorine substituent enhances reactivity in electrophilic aromatic substitution and cross-coupling reactions, while the diamine functionality allows for further derivatization, such as polymerization or heterocycle formation. The compound is particularly useful in the development of agrochemicals, dyes, and specialty polymers. Its well-defined structure and consistent purity make it a reliable building block for research and industrial processes requiring precise molecular control.
5-fluorobenzene-1,3-diamine structure
5-fluorobenzene-1,3-diamine structure
Product Name:5-fluorobenzene-1,3-diamine
CAS No:372-41-8
MF:C6H7FN2
MW:126.131584405899
MDL:MFCD12763398
CID:291580
PubChem ID:23423547
Update Time:2025-08-04

5-fluorobenzene-1,3-diamine Chemical and Physical Properties

Names and Identifiers

    • 1,3-Benzenediamine, 5-fluoro-
    • 5-fluorobenzene-1,3-diamine
    • 372-41-8
    • SCHEMBL1100115
    • EN300-219360
    • CS-0239807
    • DTXSID60633914
    • 1,3-diamino-5-fluorobenzene
    • 5-fluoro-benzene-1,3-diamine
    • LIYOGZUQGPRENF-UHFFFAOYSA-N
    • MDL: MFCD12763398
    • Inchi: 1S/C6H7FN2/c7-4-1-5(8)3-6(9)2-4/h1-3H,8-9H2
    • InChI Key: LIYOGZUQGPRENF-UHFFFAOYSA-N
    • SMILES: FC1C=C(C=C(C=1)N)N

Computed Properties

  • Exact Mass: 126.05932639g/mol
  • Monoisotopic Mass: 126.05932639g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 87.1
  • 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: 0.7
  • Topological Polar Surface Area: 52?2

Experimental Properties

  • Color/Form: No data avaiable

5-fluorobenzene-1,3-diamine Security Information

5-fluorobenzene-1,3-diamine Pricemore >>

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Additional information on 5-fluorobenzene-1,3-diamine

Comprehensive Overview of 5-Fluorobenzene-1,3-diamine (CAS No. 372-41-8): Properties, Applications, and Industry Trends

5-Fluorobenzene-1,3-diamine (CAS No. 372-41-8), also known as 1,3-diamino-5-fluorobenzene, is a fluorinated aromatic diamine compound with significant relevance in pharmaceutical, agrochemical, and material science industries. Its molecular structure, featuring both amino and fluorine functional groups, enables unique reactivity and versatility in synthetic applications. This article delves into its chemical properties, industrial uses, and emerging trends aligned with current market demands, such as green chemistry and sustainable synthesis.

The compound's CAS registry number 372-41-8 serves as a critical identifier for researchers and regulatory bodies. With a molecular formula of C6H7FN2, it exhibits a molar mass of 126.13 g/mol and typically appears as a light-colored crystalline solid. Its fluorine substitution enhances electron-withdrawing effects, influencing its reactivity in nucleophilic aromatic substitution (SNAr) reactions—a topic frequently searched by organic chemists exploring heterocyclic compound synthesis.

In pharmaceuticals, 5-fluorobenzene-1,3-diamine acts as a key intermediate for anticancer agents and antiviral drugs, reflecting the growing interest in precision medicine and targeted therapies. Recent studies highlight its role in developing kinase inhibitors, a hot topic in oncology research. The compound's bioisosteric potential (often queried in AI-driven drug discovery platforms) makes it valuable for optimizing drug bioavailability and metabolic stability.

Material scientists leverage this diamine for synthesizing high-performance polymers, including polyimides and epoxy resins, which are essential for aerospace and electronics applications. Searches for heat-resistant polymers and flexible electronics materials have surged, aligning with the compound's utility in these domains. Its incorporation into covalent organic frameworks (COFs) also addresses the demand for porous materials in gas storage and catalysis.

Environmental considerations drive innovations in the synthesis of 372-41-8. Researchers are exploring catalytic fluorination methods and solvent-free reactions to reduce waste—a response to the popularity of search terms like eco-friendly chemical synthesis. Regulatory compliance with REACH and FDA guidelines further underscores the need for sustainable production practices.

Analytical techniques for characterizing 5-fluorobenzene-1,3-diamine include HPLC, GC-MS, and NMR spectroscopy, with 19F-NMR being particularly useful due to the fluorine atom. These methods are frequently discussed in forums on chemical purity standards, another trending topic among quality control professionals.

In summary, CAS No. 372-41-8 represents a multifaceted compound bridging diverse scientific disciplines. Its applications in drug development, advanced materials, and green chemistry position it at the forefront of industrial and academic research, answering the call for innovative solutions in a rapidly evolving technological landscape.

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