Cas no 83217-10-1 (4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE)

4,6-Dichloro-2-[3-(trifluoromethyl)phenyl]pyrimidine is a versatile pyrimidine-based intermediate widely used in pharmaceutical and agrochemical synthesis. Its key structural features include two reactive chlorine atoms at the 4- and 6-positions, enabling selective nucleophilic substitution reactions, and a 3-(trifluoromethyl)phenyl group that enhances lipophilicity and bioactivity. The trifluoromethyl moiety contributes to improved metabolic stability and binding affinity in target molecules. This compound is particularly valuable in the development of heterocyclic derivatives for medicinal chemistry applications, such as kinase inhibitors and antimicrobial agents. Its high purity and consistent reactivity make it a reliable building block for complex molecular architectures. Proper handling under inert conditions is recommended due to its sensitivity to moisture.
4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE structure
83217-10-1 structure
Product Name:4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE
CAS No:83217-10-1
MF:C11H5Cl2F3N2
MW:293.072010755539
CID:1807530
PubChem ID:53440046
Update Time:2025-11-02

4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE Chemical and Physical Properties

Names and Identifiers

    • 4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE
    • 83217-10-1
    • AKOS006235140
    • DTXSID10702321
    • 4,6-Dichloro-2-(3-trifluoromethylphenyl)pyrimidine
    • Z1140391416
    • F84005
    • 4,6-Dichloro-2-(3-(trifluoromethyl)phenyl)pyrimidine
    • CS-0432838
    • EN300-6497568
    • Inchi: 1S/C11H5Cl2F3N2/c12-8-5-9(13)18-10(17-8)6-2-1-3-7(4-6)11(14,15)16/h1-5H
    • InChI Key: VTHOZCSKDRAOGU-UHFFFAOYSA-N
    • SMILES: ClC1=CC(=NC(C2=CC=CC(C(F)(F)F)=C2)=N1)Cl

Computed Properties

  • Exact Mass: 291.9781880g/mol
  • Monoisotopic Mass: 291.9781880g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 278
  • 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: 5.1
  • Topological Polar Surface Area: 25.8?2

4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE Pricemore >>

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Additional information on 4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE

4,6-DICHLORO-2-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE (CAS No. 83217-10-1): A Versatile Intermediate in Pharmaceutical and Agrochemical Applications

4,6-Dichloro-2-[3-(trifluoromethyl)phenyl]pyrimidine (CAS No. 83217-10-1) is a highly specialized pyrimidine derivative that has garnered significant attention in recent years due to its unique chemical properties and broad utility in pharmaceutical and agrochemical research. This compound, characterized by its dichloro-substituted pyrimidine ring and trifluoromethylphenyl moiety, serves as a crucial building block for the synthesis of various bioactive molecules.

The growing demand for fluorinated pyrimidine compounds in drug discovery has positioned 4,6-dichloro-2-(3-(trifluoromethyl)phenyl)pyrimidine as a valuable intermediate. Researchers are particularly interested in its potential applications for developing kinase inhibitors, which are currently a hot topic in cancer research and autoimmune disease treatment. The presence of both chloro and trifluoromethyl groups enhances the compound's reactivity, making it ideal for further functionalization through cross-coupling reactions.

In the agrochemical sector, 4,6-dichloro-2-[3-(trifluoromethyl)phenyl]pyrimidine has shown promise as a precursor for novel crop protection agents. With increasing global focus on sustainable agriculture and the need for more efficient pesticides, this compound's structural features align well with current market demands. The trifluoromethyl group in particular is known to improve the biological activity and metabolic stability of agrochemicals, addressing common questions about pesticide effectiveness and environmental persistence.

From a chemical perspective, CAS 83217-10-1 exhibits several noteworthy characteristics. The electron-withdrawing nature of both the chloro substituents and the trifluoromethyl group creates an electron-deficient pyrimidine ring system that is highly reactive toward nucleophilic aromatic substitution. This property makes it valuable for researchers investigating heterocyclic chemistry and medicinal chemistry applications, topics that frequently appear in scientific literature searches.

The synthesis of 4,6-dichloro-2-(3-(trifluoromethyl)phenyl)pyrimidine typically involves condensation reactions between appropriately substituted precursors, followed by chlorination steps. Recent advances in green chemistry have led to improved synthetic routes that reduce environmental impact while maintaining high yields—a development that responds to growing industry concerns about sustainable manufacturing processes.

Market analysis indicates steady growth in demand for fluorinated pyrimidine derivatives like 83217-10-1, particularly from pharmaceutical companies developing next-generation therapeutics. The compound's versatility allows for the creation of diverse molecular architectures, addressing current research trends toward targeted therapies and personalized medicine. These applications frequently appear in search queries related to cutting-edge drug development.

Quality control of 4,6-dichloro-2-[3-(trifluoromethyl)phenyl]pyrimidine is crucial for its applications, with HPLC and NMR being standard analytical techniques. Purity requirements often exceed 98%, reflecting the compound's use in sensitive synthetic pathways. This emphasis on quality aligns with industry-wide discussions about chemical standardization and process optimization, common search terms among professionals in the field.

Storage and handling of CAS 83217-10-1 require standard laboratory precautions for halogenated compounds. While not classified as hazardous under normal conditions, proper ventilation and protective equipment are recommended—a practical consideration that frequently appears in safety-related searches for laboratory chemicals.

The future outlook for 4,6-dichloro-2-(3-(trifluoromethyl)phenyl)pyrimidine appears promising, with ongoing research exploring its potential in new therapeutic areas and advanced material science. As the pharmaceutical industry continues to prioritize fluorine-containing compounds and heterocyclic scaffolds, this intermediate is likely to maintain its relevance in chemical synthesis pipelines.

For researchers and manufacturers, sourcing high-quality 83217-10-1 from reliable suppliers remains essential. The compound's specialized nature means that technical support and detailed product specifications are valuable considerations—factors that often influence purchasing decisions in the fine chemicals market.

In conclusion, 4,6-dichloro-2-[3-(trifluoromethyl)phenyl]pyrimidine represents an important tool in modern chemical research and development. Its unique combination of structural features and reactivity patterns continues to inspire innovation across multiple scientific disciplines, from drug discovery to agrochemical design. As industry trends evolve toward more sophisticated and targeted chemical solutions, this compound's significance is expected to grow accordingly.

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