Cas no 61062-55-3 (2-Phenyl-4’-trifluoromethylacetophenone)

2-Phenyl-4’-trifluoromethylacetophenone is a fluorinated aromatic ketone characterized by the presence of a phenyl group and a trifluoromethyl substituent on the acetophenone backbone. This compound is valued for its structural versatility in organic synthesis, particularly as an intermediate in the preparation of pharmaceuticals, agrochemicals, and advanced materials. The trifluoromethyl group enhances its electron-withdrawing properties, improving reactivity in cross-coupling and nucleophilic substitution reactions. Its stability under various reaction conditions makes it suitable for use in multi-step synthetic processes. The compound’s well-defined molecular structure ensures consistent performance in applications requiring high purity and precise functionalization.
2-Phenyl-4’-trifluoromethylacetophenone structure
61062-55-3 structure
Product Name:2-Phenyl-4’-trifluoromethylacetophenone
CAS No:61062-55-3
MF:C15H11F3O
MW:264.242454767227
CID:529879
PubChem ID:318234
Update Time:2025-11-02

2-Phenyl-4’-trifluoromethylacetophenone Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 2-phenyl-1-[4-(trifluoromethyl)phenyl]-
    • 2-Phenyl-4’-trifluoromethylacetophenone
    • 2-phenyl-1-[4-(trifluoromethyl)phenyl]ethanone
    • 2-Phenyl-4'-trifluoroMethylacetophenone
    • 2-phenyl-1-(4-(trifluoromethyl)phenyl)ethanone
    • SCHEMBL1515765
    • MFCD02260678
    • NSC-254072
    • 61062-55-3
    • AKOS006123088
    • Ethanone,2-phenyl-1-[4-(trifluoromethyl)phenyl]-
    • 4-(Trifluoromethyl)deoxybenzoin
    • DTXSID20312379
    • NSC254072
    • 2-phenyl-1-[4-(trifluoromethyl)phenyl]ethan-1-one
    • MDL: MFCD02260678
    • Inchi: 1S/C15H11F3O/c16-15(17,18)13-8-6-12(7-9-13)14(19)10-11-4-2-1-3-5-11/h1-9H,10H2
    • InChI Key: SOHDNUBGOFCYMP-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC(=CC=1)C(CC1C=CC=CC=1)=O)(F)F

Computed Properties

  • Exact Mass: 264.07600
  • Monoisotopic Mass: 264.07619946g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 297
  • 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: 4.1
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 4.13080

2-Phenyl-4’-trifluoromethylacetophenone Security Information

2-Phenyl-4’-trifluoromethylacetophenone Customs Data

  • HS CODE:2914700090
  • Customs Data:

    China Customs Code:

    2914700090

    Overview:

    2914700090 Halogenation of other ketones and quinones\Sulfonated derivative(Including nitrated and nitrosative derivatives). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acetone declared packaging

    Summary:

    HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

2-Phenyl-4’-trifluoromethylacetophenone Pricemore >>

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Additional information on 2-Phenyl-4’-trifluoromethylacetophenone

Exploring the Properties and Applications of 2-Phenyl-4’-trifluoromethylacetophenone (CAS No. 61062-55-3)

2-Phenyl-4’-trifluoromethylacetophenone (CAS No. 61062-55-3) is a specialized organic compound that has garnered significant attention in the fields of pharmaceuticals, agrochemicals, and material science. This ketone derivative is characterized by its unique molecular structure, which includes a phenyl group and a trifluoromethyl group. The presence of the trifluoromethyl group enhances its reactivity and stability, making it a valuable intermediate in synthetic chemistry. Researchers and industry professionals often search for high-purity 2-Phenyl-4’-trifluoromethylacetophenone due to its critical role in the development of advanced materials and bioactive molecules.

One of the most frequently asked questions about CAS No. 61062-55-3 revolves around its synthesis and purification methods. The compound is typically synthesized via Friedel-Crafts acylation, a well-established reaction in organic chemistry. The process involves the reaction of benzene derivatives with trifluoromethylacetyl chloride in the presence of a Lewis acid catalyst. The demand for ultra-pure 2-Phenyl-4’-trifluoromethylacetophenone has surged in recent years, driven by its applications in pharmaceutical intermediates and specialty chemicals. This aligns with the growing trend of green chemistry and sustainable synthesis, as researchers seek eco-friendly alternatives to traditional methods.

In the pharmaceutical industry, 2-Phenyl-4’-trifluoromethylacetophenone is a key building block for the synthesis of drug candidates targeting various diseases. Its fluorinated aromatic structure is particularly valuable in the design of bioactive molecules with improved metabolic stability and bioavailability. Recent studies have highlighted its potential in developing anti-inflammatory agents and central nervous system (CNS) drugs, addressing the rising demand for novel therapeutics. The compound’s versatility also extends to agrochemical applications, where it serves as a precursor for crop protection chemicals with enhanced efficacy.

The material science community has also embraced CAS No. 61062-55-3 for its role in creating advanced polymers and functional materials. The trifluoromethyl group imparts unique electronic and hydrophobic properties, making it ideal for high-performance coatings and electronic materials. With the increasing focus on smart materials and nanotechnology, this compound is poised to play a pivotal role in next-generation innovations. Industry experts often search for suppliers of 2-Phenyl-4’-trifluoromethylacetophenone to meet the demands of cutting-edge research and development.

From an analytical perspective, the characterization of 2-Phenyl-4’-trifluoromethylacetophenone involves advanced techniques such as nuclear magnetic resonance (NMR) spectroscopy and high-performance liquid chromatography (HPLC). These methods ensure the compound’s purity and consistency, which are critical for its applications in sensitive industries. The compound’s molecular weight and melting point are also frequently queried by researchers, underscoring the importance of accurate technical data. As the demand for custom synthesis and tailor-made chemicals grows, CAS No. 61062-55-3 remains a focal point for innovation.

In conclusion, 2-Phenyl-4’-trifluoromethylacetophenone (CAS No. 61062-55-3) is a multifaceted compound with broad applications across diverse industries. Its unique chemical properties and versatility make it a sought-after material for researchers and manufacturers alike. Whether in drug discovery, agrochemical development, or material science, this compound continues to drive progress and inspire new solutions. For those seeking high-quality 2-Phenyl-4’-trifluoromethylacetophenone, understanding its synthesis, properties, and applications is essential for leveraging its full potential.

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