Cas no 345-71-1 ((3-Fluorophenyl)(4-fluorophenyl)methanone)

(3-Fluorophenyl)(4-fluorophenyl)methanone structure
345-71-1 structure
Product Name:(3-Fluorophenyl)(4-fluorophenyl)methanone
CAS No:345-71-1
MF:C13H8F2O
MW:218.198830604553
MDL:MFCD00070811
CID:293755
PubChem ID:520691
Update Time:2025-04-23

(3-Fluorophenyl)(4-fluorophenyl)methanone Chemical and Physical Properties

Names and Identifiers

    • (3-Fluorophenyl)(4-fluorophenyl)methanone
    • (3-fluorophenyl)-(4-fluorophenyl)methanone
    • 3,4'-Difluorobenzophenone
    • Methanone,(3-fluorophenyl)(4-fluorophenyl)-
    • 3,4'-Difluor-benzophenon
    • 3,4'-difluoro-benzophenone
    • 3-fluorophenyl 4-fluorophenyl methanone
    • m,p'-Difluorbenzophenon
    • m-Fluor-p'-fluorbenzophenon
    • PS-11163
    • ZHUXSAKDWNNBCQ-UHFFFAOYSA-N
    • (3-Fluoro-phenyl)-(4-fluoro-phenyl)-methanone
    • AKOS003261126
    • (3-Fluorophenyl)(4-fluorophenyl)methanone #
    • A822283
    • MFCD00070811
    • EN300-7382439
    • CS-0206277
    • DTXSID20334430
    • 3,4''-DIFLUOROBENZOPHENONE
    • SCHEMBL3038873
    • Methanone, (3-fluorophenyl)(4-fluorophenyl)-
    • F75626
    • 345-71-1
    • DTXCID30285520
    • MDL: MFCD00070811
    • Inchi: 1S/C13H8F2O/c14-11-6-4-9(5-7-11)13(16)10-2-1-3-12(15)8-10/h1-8H
    • InChI Key: ZHUXSAKDWNNBCQ-UHFFFAOYSA-N
    • SMILES: FC1=CC=CC(=C1)C(C1C=CC(=CC=1)F)=O

Computed Properties

  • Exact Mass: 218.05400
  • Monoisotopic Mass: 218.05432120g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 246
  • 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: 3.5
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 3.19580

(3-Fluorophenyl)(4-fluorophenyl)methanone 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%

(3-Fluorophenyl)(4-fluorophenyl)methanone Pricemore >>

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(3-Fluorophenyl)(4-fluorophenyl)methanone Production Method

(3-Fluorophenyl)(4-fluorophenyl)methanone Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:345-71-1)(3-Fluorophenyl)(4-fluorophenyl)methanone
Order Number:A822283
Stock Status:in Stock
Quantity:25g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:09
Price ($):230.0

Additional information on (3-Fluorophenyl)(4-fluorophenyl)methanone

The Synthesis, Properties, and Applications of (3-Fluorophenyl)(4-Fluorophenyl)methanone

In the realm of organic chemistry, (3-fluorophenyl)(4-fluorophenyl)methanone stands out as a compound of significant interest due to its unique structure and potential applications in various fields. This molecule, also referred to by its CAS registry number 345-71-1, is a fluorinated aromatic ketone that has garnered attention for its role in pharmaceuticals, materials science, and environmental chemistry.

The compound consists of two fluorobenzene rings—fluorophenyl groups—with one ring substituted at the 3-position and the other at the 4-position. These rings are connected via a methylene group (-CH2-) to form methanone, making it a symmetric structure with distinct electronic properties due to the presence of fluorine atoms. Fluorine, being highly electronegative, significantly influences the reactivity and stability of the molecule.

Recent studies have highlighted the importance of fluorinated aromatic compounds in drug discovery. The introduction of fluorine into aromatic rings often enhances the lipophilicity and metabolic stability of potential drug candidates. In the case of (3-fluorophenyl)(4-fluorophenyl)methanone, its dual fluorination at ortho and para positions creates a molecule with unique electronic and steric properties, which could be harnessed for designing bioactive agents.

One of the most notable aspects of 345-71-1 is its potential as a template for drug development. The ketone group in the structure renders it susceptible to nucleophilic addition reactions, making it a versatile precursor for synthesizing more complex molecules. For instance, recent research has explored the use of this compound in the synthesis of fluorinated diketones, which are valuable intermediates in the pharmaceutical industry.

Furthermore, the environmental chemistry implications of (3-fluorophenyl)(4-fluorophenyl)methanone cannot be overlooked. Fluorinated compounds are known for their persistence in the environment and potential bioaccumulation. Studies have examined the degradation pathways of this compound under various conditions, including biodegradation and photocatalytic processes, to assess its environmental fate and toxicity.

In terms of synthesis, 345-71-1 can be prepared via a variety of methods. One of the most efficient routes involves the coupling of two fluorobenzene derivatives with an oxidizing agent to form the ketone group. This method has been optimized in recent years to improve yield and reduce reaction time, making it more feasible for large-scale production.

Recent advancements in fluorination techniques have also contributed to a better understanding of how to control the substitution patterns on the aromatic rings. This precision is crucial for tailoring the properties of (3-fluorophenyl)(4-fluorophenyl)methanone to meet specific application needs, whether in pharmaceuticals or materials science.

Another area of active research involving this compound is its role as a model system for studying electron transfer processes. The presence of fluorine atoms introduces asymmetry into the molecule, which can be exploited in designing electron-deficient aromatics for applications in organic electronics, such as OLEDs or sensors.

Moreover, the biological activity of (3-fluorophenyl)(4-fluorophenyl)methanone has been explored in various contexts. In vitro studies have demonstrated its potential as an inhibitor of certain enzymes and receptors, suggesting its utility in drug development for treating conditions such as cancer or inflammation.

Despite its promising applications, the handling and disposal of 345-71-1 require careful consideration due to its fluorinated nature. Research continues to focus on developing sustainable practices for its synthesis and use, ensuring minimal environmental impact while maximizing its benefits in various industries.

In conclusion, (3-fluorophenyl)(4-fluorophenyl)methanone, CAS No. 345-71-1, is a multifaceted compound with significant potential in pharmaceuticals, materials science, and environmental chemistry. Its unique structure, combining the electronic effects of fluorine atoms with the reactivity of a ketone group, makes it a valuable tool for researchers and industries alike. As our understanding of its properties continues to evolve, so too will its applications in addressing pressing scientific and technological challenges.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:345-71-1)(3-Fluorophenyl)(4-fluorophenyl)methanone
A822283
Purity:99%
Quantity:25g
Price ($):230.0
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