Cas no 1597-40-6 (3,3-Difluoroallyl acetate)

3,3-Difluoroallyl acetate is a fluorinated allyl ester with the molecular formula C?H?F?O?. It is characterized by the presence of two fluorine atoms at the 3-position of the allyl group, enhancing its reactivity in electrophilic and nucleophilic transformations. This compound is particularly valuable in synthetic organic chemistry as a versatile building block for introducing difluoroallyl motifs into target molecules. Its acetate group facilitates further functionalization under mild conditions, making it useful in the synthesis of fluorinated pharmaceuticals, agrochemicals, and specialty materials. The compound's stability and selective reactivity contribute to its utility in precision fluorination reactions. Proper handling under inert conditions is recommended due to its potential sensitivity to moisture and heat.
3,3-Difluoroallyl acetate structure
3,3-Difluoroallyl acetate structure
Product Name:3,3-Difluoroallyl acetate
CAS No:1597-40-6
MF:C5H6F2O2
MW:136.096748828888
CID:2656429
Update Time:2025-06-14

3,3-Difluoroallyl acetate Chemical and Physical Properties

Names and Identifiers

    • 3,3-Difluoro-2-propen-1-ol acetate
    • 3,3-difluoroprop-2-enyl acetate
    • 3,3-Difluoroallyl acetate
    • 3,3-Difluoro-2-propenyl acetate
    • 2-Propen-1-ol, 3,3-difluoro-, acetate
    • SFMCWVFEKGYGMH-UHFFFAOYSA-N
    • PC8369
    • 3,3-Difluoro-2-propenyl acetate #
    • FCH1165947
    • Inchi: 1S/C5H6F2O2/c1-4(8)9-3-2-5(6)7/h2H,3H2,1H3
    • InChI Key: SFMCWVFEKGYGMH-UHFFFAOYSA-N
    • SMILES: F/C(=C/COC(C)=O)/F

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 3
  • Complexity: 127
  • XLogP3: 1
  • Topological Polar Surface Area: 26.3

3,3-Difluoroallyl acetate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Apollo Scientific
PC8369-1g
3,3-Difluoroallyl acetate
1597-40-6
1g
£180.00 2024-05-26
Apollo Scientific
PC8369-5g
3,3-Difluoroallyl acetate
1597-40-6
5g
£450.00 2024-05-26
TRC
D456063-50mg
3,3-Difluoroallyl acetate
1597-40-6
50mg
$ 50.00 2022-06-05
TRC
D456063-100mg
3,3-Difluoroallyl acetate
1597-40-6
100mg
$ 70.00 2022-06-05
TRC
D456063-500mg
3,3-Difluoroallyl acetate
1597-40-6
500mg
$ 230.00 2022-06-05

Additional information on 3,3-Difluoroallyl acetate

Comprehensive Overview of 3,3-Difluoroallyl Acetate (CAS No. 1597-40-6): Properties, Applications, and Industry Trends

3,3-Difluoroallyl acetate (CAS No. 1597-40-6) is a specialized fluorinated organic compound gaining attention in modern chemical research and industrial applications. This ester derivative, characterized by its difluoroallyl moiety, exhibits unique physicochemical properties that make it valuable for synthetic chemistry, material science, and specialty formulations. As industries increasingly prioritize sustainable fluorochemicals and high-performance intermediates, compounds like 3,3-Difluoroallyl acetate are being explored for their versatility and efficiency.

The molecular structure of 3,3-Difluoroallyl acetate combines an acetate group with a difluoro-substituted allyl chain, resulting in enhanced reactivity and stability under specific conditions. Researchers highlight its role as a building block in organic synthesis, particularly for introducing fluorine atoms into target molecules—a process critical for developing agrochemicals, pharmaceutical intermediates, and advanced materials. Recent studies emphasize its utility in click chemistry and polymer modification, aligning with the growing demand for eco-friendly chemical processes.

From an industrial perspective, 3,3-Difluoroallyl acetate is manufactured under controlled conditions to ensure high purity (>98%), a key factor for applications requiring precise stoichiometry. Analytical techniques such as GC-MS and NMR spectroscopy are routinely employed to verify its composition. The compound's low viscosity and moderate volatility make it suitable for formulations where controlled release or solubility enhancement is desired. Notably, its compatibility with green solvents has sparked interest in bio-based product development, a trending topic in circular economy discussions.

Emerging applications of 3,3-Difluoroallyl acetate include its use in electronic materials for flexible displays and organic semiconductors, where fluorine incorporation improves thermal stability and charge transport. This aligns with global searches for "fluorine in OLED technology" and "high-performance dielectric materials." Additionally, its potential in crop protection agents reflects the agricultural sector's need for low-residue formulations, addressing consumer concerns about food safety and environmental impact.

Quality control protocols for CAS No. 1597-40-6 emphasize stringent storage recommendations—typically under inert gas at controlled temperatures—to maintain its shelf life. Regulatory compliance with REACH and FDA guidelines ensures its safe handling in global markets. As synthetic methodologies evolve, innovations like flow chemistry and catalytic fluorination are expected to optimize the production efficiency of this compound, reducing energy consumption and waste generation.

In conclusion, 3,3-Difluoroallyl acetate represents a convergence of cutting-edge chemistry and industrial practicality. Its multifaceted applications respond to contemporary challenges in material innovation and process sustainability, making it a compound of significant scientific and commercial interest. Ongoing research will likely uncover further opportunities, particularly in energy storage systems and biocompatible coatings, areas frequently queried in academic and industrial databases.

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