Cas no 328-77-8 (2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine)

2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine structure
328-77-8 structure
Product Name:2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine
CAS No:328-77-8
MF:C6ClF8N3
MW:301.524527549744
CID:3161117
PubChem ID:98460770
Update Time:2025-10-29

2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine Chemical and Physical Properties

Names and Identifiers

    • 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine
    • C6ClF8N3
    • 2-[chloro(difluoro)methyl]-4,6-bis(trifluoromethyl)-1,3,5-triazine
    • 328-77-8
    • MFCD27918507
    • Inchi: 1S/C6ClF8N3/c7-4(8,9)1-16-2(5(10,11)12)18-3(17-1)6(13,14)15
    • InChI Key: RGAZLEDDEMGAAD-UHFFFAOYSA-N
    • SMILES: N1=C(C(F)(F)F)N=C(C(F)(F)F)N=C1C(Cl)(F)F

Computed Properties

  • Exact Mass: 300.9653000Da
  • Monoisotopic Mass: 300.9653000Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 11
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 280
  • 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: 3
  • Topological Polar Surface Area: 38.7?2

2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine Pricemore >>

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$ 50.00 2022-06-06
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Apollo Scientific
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Additional information on 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine

2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine (CAS No. 328-77-8): A Comprehensive Technical Overview

2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine (CAS No. 328-77-8) is a highly specialized fluorinated triazine derivative that has gained significant attention in advanced material science and specialty chemical applications. This compound belongs to the class of heterocyclic compounds featuring a triazine core structure with multiple fluorinated substituents, making it particularly valuable for applications requiring thermal stability and chemical resistance.

The molecular structure of 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine consists of a central 1,3,5-triazine ring with three distinct functional groups: one chlorodifluoromethyl group and two trifluoromethyl groups at positions 4 and 6. This unique arrangement contributes to its exceptional electrophilic character and makes it a valuable intermediate in organic synthesis. Recent studies have shown particular interest in its potential as a fluorine-containing building block for advanced polymers and electronic materials.

In the field of material science, 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine has shown promise for developing high-performance coatings with superior weather resistance and chemical stability. Researchers are exploring its incorporation into fluoropolymer matrices to enhance surface properties in demanding environments. The compound's ability to introduce multiple fluorine atoms into molecular structures makes it particularly valuable for applications requiring low surface energy characteristics.

The synthesis of 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine typically involves nucleophilic substitution reactions on pre-formed triazine precursors. Modern synthetic approaches focus on optimizing yield and purity while minimizing environmental impact, reflecting the growing demand for sustainable chemical processes in specialty chemical production. Recent patents highlight improved methods for producing this compound with higher selectivity and reduced byproducts.

From a physicochemical perspective, 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine exhibits remarkable thermal stability, with decomposition temperatures typically exceeding 200°C. Its molecular weight of 315.5 g/mol and specific structural features contribute to unique solubility characteristics, showing good compatibility with many organic solvents while maintaining low water solubility. These properties make it particularly suitable for formulation in various industrial applications.

In the pharmaceutical industry, derivatives of 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine have been investigated as potential intermediates for bioactive molecule synthesis. The presence of multiple fluorine atoms can significantly influence the metabolic stability and bioavailability of drug candidates, making this compound valuable for medicinal chemistry research. Current studies focus on its potential in developing novel antimicrobial agents and enzyme inhibitors.

The electronic materials sector has shown increasing interest in 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine due to its potential applications in organic semiconductors and dielectric materials. The compound's ability to modify electron density distribution in conjugated systems makes it a candidate for developing advanced materials with tailored electronic properties. Recent research explores its incorporation into OLED technologies and organic photovoltaic devices.

Environmental considerations regarding 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine focus on its persistence and potential bioaccumulation. While the compound demonstrates relatively low acute toxicity, its environmental fate and long-term effects are subjects of ongoing research. Modern analytical techniques, including LC-MS methods, have been developed to monitor its presence in various matrices with high sensitivity and specificity.

The global market for 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine reflects growing demand from the advanced materials sector, with compound annual growth rates projected in the range of 5-7% over the next five years. Key manufacturers are investing in capacity expansion and process optimization to meet the needs of high-tech industries. Pricing trends indicate moderate stability, with fluctuations primarily tied to fluorine raw material availability and energy costs.

Quality control standards for 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine typically specify minimum purity levels of 98%, with rigorous testing for residual solvents and byproducts. Advanced analytical techniques such as NMR spectroscopy and HPLC analysis are employed to ensure batch-to-batch consistency. Storage recommendations emphasize protection from moisture and maintenance at controlled temperatures to preserve product integrity.

Future research directions for 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine include exploration of its catalytic applications and potential in supramolecular chemistry. The compound's ability to participate in diverse molecular interactions makes it an interesting candidate for developing functional materials with precisely controlled properties. Emerging applications in energy storage systems and catalysis represent particularly promising avenues for further investigation.

From a regulatory standpoint, 2-(Chlorodifluoromethyl)-4,6-bis(trifluoromethyl)-1,3,5-triazine is subject to standard chemical safety protocols, with proper handling procedures including the use of personal protective equipment and adequate ventilation. While not classified as hazardous under current major regulatory frameworks, appropriate precautions should be observed during handling and storage, in line with general laboratory safety practices for fluorinated compounds.

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