Cas no 1215295-88-7 (4,5-Dichloro-2-methylbenzenesulfonyl Chloride)

4,5-Dichloro-2-methylbenzenesulfonyl chloride is a sulfonyl chloride derivative used primarily as an intermediate in organic synthesis. Its reactive sulfonyl chloride group enables efficient conversion into sulfonamides, sulfonate esters, and other functionalized compounds, making it valuable in pharmaceutical and agrochemical applications. The dichloro and methyl substituents enhance its reactivity and selectivity in electrophilic aromatic substitution reactions. This compound is characterized by high purity and stability under controlled conditions, ensuring consistent performance in synthetic workflows. Its utility in constructing complex molecular architectures underscores its importance in fine chemical and research applications. Proper handling is required due to its moisture sensitivity and potential corrosivity.
4,5-Dichloro-2-methylbenzenesulfonyl Chloride structure
1215295-88-7 structure
Product Name:4,5-Dichloro-2-methylbenzenesulfonyl Chloride
CAS No:1215295-88-7
MF:C7H5Cl3O2S
MW:259.537398099899
MDL:MFCD12402636
CID:1088323
PubChem ID:50876020
Update Time:2025-11-02

4,5-Dichloro-2-methylbenzenesulfonyl Chloride Chemical and Physical Properties

Names and Identifiers

    • 4,5-Dichloro-2-methylbenzene-1-sulfonyl chloride
    • 4,5-Dichloro-2-methylbenzenesulfonyl chloride
    • 4,5-dichloro-2-methylbenzenesulfonyl chloride(SALTDATA: FREE)
    • 1215295-88-7
    • BS-37249
    • AKOS005139193
    • 4,5-Dichloro-2-methylbenzene-1-sulfonylchloride
    • 4,5-Dichloro-2-methyl-benzenesulfonyl chloride
    • MFCD12402636
    • SCHEMBL26512818
    • CS-0338651
    • 4,5-Dichloro-2-methylbenzenesulfonyl Chloride
    • MDL: MFCD12402636
    • Inchi: 1S/C7H5Cl3O2S/c1-4-2-5(8)6(9)3-7(4)13(10,11)12/h2-3H,1H3
    • InChI Key: TYZBDEJHZYVWRM-UHFFFAOYSA-N
    • SMILES: ClS(C1C=C(C(=CC=1C)Cl)Cl)(=O)=O

Computed Properties

  • Exact Mass: 257.907584g/mol
  • Monoisotopic Mass: 257.907584g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 272
  • 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: 3.6
  • Topological Polar Surface Area: 42.5?2

4,5-Dichloro-2-methylbenzenesulfonyl Chloride Pricemore >>

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Additional information on 4,5-Dichloro-2-methylbenzenesulfonyl Chloride

Comprehensive Overview of 4,5-Dichloro-2-methylbenzenesulfonyl Chloride (CAS No. 1215295-88-7): Properties, Applications, and Industry Insights

4,5-Dichloro-2-methylbenzenesulfonyl Chloride (CAS No. 1215295-88-7) is a specialized sulfonyl chloride derivative widely recognized for its role in organic synthesis and pharmaceutical intermediates. This compound, characterized by its dichloro-methyl-substituted benzene ring, exhibits unique reactivity, making it valuable for constructing complex molecular architectures. With the growing demand for high-purity chemical reagents in drug discovery and material science, this compound has garnered significant attention in research and industrial applications.

The molecular structure of 4,5-Dichloro-2-methylbenzenesulfonyl Chloride features a sulfonyl chloride functional group (–SO2Cl), which serves as a versatile precursor for sulfonamides, sulfonate esters, and other sulfur-containing compounds. Researchers frequently employ it in nucleophilic substitution reactions, leveraging its reactivity with amines or alcohols. Its chloro-methyl substitution pattern further enhances its utility in regioselective transformations, a topic frequently searched in organic chemistry forums and synthetic methodology studies.

In the context of green chemistry trends, the compound’s efficient synthesis and minimal byproduct formation align with the industry’s shift toward sustainable chemical processes. Recent publications highlight its use in catalyzed reactions, where it contributes to atom economy—a key metric in environmentally friendly synthesis. This aligns with frequent search queries such as "eco-friendly sulfonation methods" and "reducing waste in organic synthesis", reflecting user interest in sustainable practices.

From an analytical perspective, 4,5-Dichloro-2-methylbenzenesulfonyl Chloride is typically characterized via NMR spectroscopy (1H and 13C) and mass spectrometry, techniques often discussed in analytical chemistry communities. Its stability under controlled conditions makes it suitable for long-term storage, though precautions like moisture-free environments are recommended—a detail frequently queried in chemical handling guidelines.

The compound’s relevance extends to agrochemical research, where sulfonyl chlorides serve as intermediates for herbicide development. This connection addresses common searches like "sulfonyl chloride applications in agriculture". Additionally, its role in dye synthesis and polymer modification underscores its interdisciplinary importance, bridging gaps between pharmaceutical, material science, and industrial chemistry sectors.

Quality control of CAS No. 1215295-88-7 involves stringent HPLC purity testing and residual solvent analysis, topics trending in QC/QA discussions. Suppliers often highlight batch-to-batch consistency, responding to user concerns about reproducibility in research. Such details are critical for laboratories requiring high-performance building blocks for precision-driven projects.

Emerging studies explore the compound’s potential in bioconjugation chemistry, particularly for modifying biomolecules—a hotspot in drug delivery system research. This aligns with frequent searches on "sulfonyl chlorides in biopharmaceuticals", demonstrating its evolving applications beyond traditional synthetic roles.

In summary, 4,5-Dichloro-2-methylbenzenesulfonyl Chloride (CAS No. 1215295-88-7) represents a multifaceted tool for modern chemistry, addressing needs from small-molecule synthesis to advanced material engineering. Its intersection with sustainability, analytical innovation, and cross-industry utility ensures its continued relevance in scientific and industrial advancements.

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