Cas no 10355-06-3 (1-Methyl-3-(methylsulfonyl)benzene)

1-Methyl-3-(methylsulfonyl)benzene is a sulfone derivative characterized by its methyl and methylsulfonyl substituents on the benzene ring. This compound is valued for its stability and utility as an intermediate in organic synthesis, particularly in pharmaceuticals and agrochemicals. The electron-withdrawing nature of the sulfonyl group enhances its reactivity in nucleophilic substitution and coupling reactions. Its well-defined structure and purity make it suitable for precise applications in research and industrial processes. The compound’s solubility in common organic solvents further facilitates its use in synthetic workflows. Careful handling is recommended due to its potential reactivity under specific conditions.
1-Methyl-3-(methylsulfonyl)benzene structure
10355-06-3 structure
Product Name:1-Methyl-3-(methylsulfonyl)benzene
CAS No:10355-06-3
MF:C8H10O2S
MW:170.228801250458
CID:1038353
PubChem ID:2760001
Update Time:2025-10-18

1-Methyl-3-(methylsulfonyl)benzene Chemical and Physical Properties

Names and Identifiers

    • 1-Methyl-3-(methylsulfonyl)benzene
    • 3-METHYLPHENYLMETHYLSULFONE
    • 1-methyl-3-methylsulfonylbenzene
    • DS-021907
    • 10355-06-3
    • AKOS006239783
    • MFCD03789191
    • 3-methanesulphonyltoluene
    • SCHEMBL12808
    • CS-0339732
    • DTXSID30374983
    • HWCMIABYHBVAJW-UHFFFAOYSA-N
    • FS-1600
    • F87695
    • 1-methanesulfonyl-3-methylbenzene
    • MDL： MFCD03789191
    • Inchi： 1S/C8H10O2S/c1-7-4-3-5-8(6-7)11(2,9)10/h3-6H,1-2H3
    • InChI Key： HWCMIABYHBVAJW-UHFFFAOYSA-N
    • SMILES： S(C)(C1C=CC=C(C)C=1)(=O)=O

Computed Properties

  • Exact Mass: 170.04000
  • Monoisotopic Mass: 170.04015073g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 213
  • 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: 1.5
  • Topological Polar Surface Area: 42.5?2

Experimental Properties

  • PSA: 42.52000
  • LogP: 2.47930

1-Methyl-3-(methylsulfonyl)benzene Customs Data

  • HS CODE：2904100000
  • Customs Data：

    China Customs Code:

    2904100000

    Overview:

    2904100000 Derivatives containing only sulfo groups and their salts and ethyl esters.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2904100000 derivatives containing only sulpho groups, their salts and ethyl esters.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

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1-Methyl-3-(methylsulfonyl)benzene Suppliers

Amadis Chemical Company Limited
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(CAS:10355-06-3)1-Methyl-3-(methylsulfonyl)benzene
Order Number:A896418
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 11:55
Price ($):274.0

1-Methyl-3-(methylsulfonyl)benzene Related Literature

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Additional information on 1-Methyl-3-(methylsulfonyl)benzene

Research Brief on 1-Methyl-3-(methylsulfonyl)benzene (CAS: 10355-06-3) in Chemical and Biomedical Applications

1-Methyl-3-(methylsulfonyl)benzene (CAS: 10355-06-3) is a sulfone derivative that has garnered significant attention in recent years due to its versatile applications in chemical synthesis and biomedical research. This compound, characterized by its methylsulfonyl functional group, serves as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. Recent studies have explored its potential as a building block for drug discovery, particularly in the development of anti-inflammatory and anticancer agents.

In a 2023 study published in the Journal of Medicinal Chemistry, researchers investigated the role of 1-Methyl-3-(methylsulfonyl)benzene in modulating inflammatory pathways. The study demonstrated that derivatives of this compound exhibited potent inhibitory effects on cyclooxygenase-2 (COX-2), a key enzyme involved in inflammation. These findings suggest its potential as a scaffold for designing novel anti-inflammatory drugs with improved efficacy and reduced side effects compared to traditional NSAIDs.

Another notable application of 1-Methyl-3-(methylsulfonyl)benzene lies in its use as a precursor in organic synthesis. A 2022 paper in Organic Letters highlighted its utility in palladium-catalyzed cross-coupling reactions, enabling the efficient construction of complex aromatic systems. This methodology has been leveraged to synthesize bioactive molecules with potential therapeutic applications, including kinase inhibitors and antimicrobial agents.

Recent advancements in analytical techniques have also facilitated a deeper understanding of the physicochemical properties of 1-Methyl-3-(methylsulfonyl)benzene. High-performance liquid chromatography (HPLC) and nuclear magnetic resonance (NMR) studies have provided insights into its stability and reactivity under various conditions, which are critical for optimizing its use in industrial and laboratory settings.

In the biomedical realm, ongoing research is exploring the compound's potential in targeted drug delivery systems. A 2023 preprint on bioRxiv reported the development of 1-Methyl-3-(methylsulfonyl)benzene-conjugated nanoparticles for enhanced solubility and controlled release of hydrophobic drugs. This innovation could address challenges related to drug bioavailability and toxicity, paving the way for more effective treatments.

Despite its promising applications, challenges remain in the large-scale production and purification of 1-Methyl-3-(methylsulfonyl)benzene. Recent efforts have focused on green chemistry approaches to improve yield and reduce environmental impact. For instance, a 2023 study in Green Chemistry demonstrated a solvent-free synthesis route using microwave irradiation, which significantly reduced reaction times and waste generation.

In conclusion, 1-Methyl-3-(methylsulfonyl)benzene (CAS: 10355-06-3) continues to be a compound of interest in both chemical and biomedical research. Its diverse applications, from drug discovery to organic synthesis, underscore its importance in advancing scientific and industrial innovation. Future research directions may include further exploration of its biological activities and the development of more sustainable production methods.

10355-06-3 (1-Methyl-3-(methylsulfonyl)benzene) Related Products

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Amadis Chemical Company Limited
(CAS:10355-06-3)1-Methyl-3-(methylsulfonyl)benzene
A896418
Purity:99%
Quantity:5g
Price ($):274.0
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