Cas no 20808-12-2 (Fluoromethyl Phenyl Sulfone)

Fluoromethyl Phenyl Sulfone is a versatile organosulfur compound characterized by the presence of a fluoromethyl group (–CH?F) and a phenyl sulfone moiety. Its unique structure imparts stability and reactivity, making it valuable in synthetic chemistry, particularly as a building block for pharmaceuticals, agrochemicals, and specialty materials. The fluorine substitution enhances electrophilicity, facilitating nucleophilic displacement reactions, while the sulfone group contributes to robust thermal and chemical stability. This compound is often employed in cross-coupling reactions and as a precursor for fluorinated intermediates. Its high purity and well-defined properties ensure consistent performance in demanding applications, including medicinal chemistry and material science research.
Fluoromethyl Phenyl Sulfone structure
Fluoromethyl Phenyl Sulfone structure
Product Name:Fluoromethyl Phenyl Sulfone
CAS No:20808-12-2
MF:C7H7FO2S
MW:174.192684412003
MDL:MFCD00191650
CID:51660
PubChem ID:87570113
Update Time:2025-05-24

Fluoromethyl Phenyl Sulfone Chemical and Physical Properties

Names and Identifiers

    • ((Fluoromethyl)sulfonyl)benzene
    • Fluoromethyl Phenyl Sulfone
    • (fluoromethylsulfonyl)benzene
    • fluoromethanesulfonyl-benzene
    • fluoromethyl benzene sulfonate
    • phenylmethylsulfonyl fluoride
    • Fluoromethylsulfonylbenzene
    • Sulfone,fluoromethyl phenyl (8CI)
    • Benzene, [(fluoromethyl)sulfonyl]-
    • fluoromethanesulfonylbenzene
    • fluoromethylphenylsulfone
    • fluoromethyl-phenyl sulfone
    • phenylsulfonylmethylflouride
    • fluoranylmethylsulfonylbenzene
    • Phenyl (fluoromethyl) sulfone
    • DENHPZASLKBBHA-UHFFFAOYSA-N
    • Benzene,[(fluoromethyl)sulfonyl]-
    • DTXSID40374616
    • SCHEMBL491319
    • AKOS005063879
    • MFCD00191650
    • FT-0676296
    • A814928
    • [(Fluoromethyl)sulfonyl]benzene, AldrichCPR
    • CS-0038264
    • 20808-12-2
    • SY018862
    • W10728
    • AS-61794
    • F0341
    • DB-014813
    • MDL: MFCD00191650
    • Inchi: 1S/C7H7FO2S/c8-6-11(9,10)7-4-2-1-3-5-7/h1-5H,6H2
    • InChI Key: DENHPZASLKBBHA-UHFFFAOYSA-N
    • SMILES: S(CF)(C1C=CC=CC=1)(=O)=O

Computed Properties

  • Exact Mass: 174.01500
  • Monoisotopic Mass: 174.01507880g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 199
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1
  • Topological Polar Surface Area: 42.5

Experimental Properties

  • Color/Form: Undetermined 2. density (g/ml, 25/4 ℃)
  • Melting Point: 51.0 to 55.0 deg-C
  • Boiling Point: 314.3℃ at 760 mmHg
  • PSA: 42.52000
  • LogP: 2.46810

Fluoromethyl Phenyl Sulfone Security Information

Fluoromethyl Phenyl Sulfone Customs Data

  • HS CODE:2904909090
  • Customs Data:

    China Customs Code:

    2904909090

    Overview:

    2904909090 Sulfonation of other hydrocarbons\nitrification\Nitrosative derivative(Whether halogenated or not). 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

    Summary:

    HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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Fluoromethyl Phenyl Sulfone Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:20808-12-2)Fluoromethyl Phenyl Sulfone
Order Number:A1199677
Stock Status:in Stock
Quantity:10g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 02:40
Price ($):190.0

Fluoromethyl Phenyl Sulfone Related Literature

Additional information on Fluoromethyl Phenyl Sulfone

Fluoromethyl Phenyl Sulfone (CAS No. 20808-12-2): A Versatile Intermediate in Modern Chemical Biology and Medicinal Chemistry

Fluoromethyl Phenyl Sulfone, identified by the chemical abstracts service number CAS No. 20808-12-2, is a highly valuable compound in the realm of chemical biology and medicinal chemistry. Its unique structural features, comprising a fluoromethyl group attached to a phenyl sulfone moiety, make it an attractive scaffold for the development of novel bioactive molecules. This compound has garnered significant attention due to its broad applicability in synthetic chemistry, drug discovery, and material science.

The phenyl sulfone moiety is a well-known pharmacophore that enhances the bioavailability and metabolic stability of pharmaceutical agents. The presence of a fluoromethyl group introduces additional functional versatility, allowing for further derivatization and modification. This dual functionality makes Fluoromethyl Phenyl Sulfone an indispensable intermediate in the synthesis of a wide range of compounds, including agrochemicals, specialty chemicals, and potential therapeutic agents.

In recent years, there has been a surge in research focused on the development of fluorinated compounds due to their enhanced biological activity and improved pharmacokinetic properties. The fluoromethyl group, in particular, is renowned for its ability to modulate lipophilicity, metabolic stability, and binding affinity. These attributes have made fluorinated derivatives highly sought after in the pharmaceutical industry. The incorporation of this moiety into molecules has been linked to increased efficacy and reduced side effects in several drug candidates.

The synthesis of Fluoromethyl Phenyl Sulfone typically involves multi-step organic transformations that highlight the compound's synthetic utility. One common approach involves the reaction of phenyl sulfonyl chloride with a Grignard reagent derived from fluoromethanol. This method underscores the compound's role as a key building block in organic synthesis. Additionally, advances in catalytic systems have enabled more efficient and sustainable routes to this intermediate, aligning with the growing emphasis on green chemistry principles.

The applications of Fluoromethyl Phenyl Sulfone extend beyond pharmaceuticals into other areas such as materials science and agrochemicals. In materials science, fluorinated compounds are valued for their thermal stability and chemical resistance, making them suitable for high-performance polymers and coatings. In agrochemicals, the introduction of fluorine atoms can enhance the efficacy of pesticides and herbicides by improving their binding affinity to biological targets.

The growing interest in fluorinated compounds has led to numerous innovative applications in drug discovery. For instance, recent studies have demonstrated the potential of Fluoromethyl Phenyl Sulfone-derived scaffolds in the development of kinase inhibitors, which are crucial for treating various cancers and inflammatory diseases. The ability to fine-tune the electronic properties of these molecules through strategic fluorination has opened new avenues for therapeutic intervention.

In conclusion, Fluoromethyl Phenyl Sulfone (CAS No. 20808-12-2) is a multifaceted compound with significant implications in chemical biology and medicinal chemistry. Its unique structural features and synthetic versatility make it an indispensable tool for researchers seeking to develop novel bioactive molecules. As our understanding of fluorine's role in biological systems continues to evolve, compounds like this are poised to play an increasingly pivotal role in shaping the future of drug discovery and materials science.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:20808-12-2)Fluoromethyl Phenyl Sulfone
A1199677
Purity:99%
Quantity:10g
Price ($):190.0
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