Cas no 52516-44-6 (2-Chloro-1-(chloromethyl)-3-methoxybenzene)

2-Chloro-1-(chloromethyl)-3-methoxybenzene is a chlorinated aromatic compound featuring both chloro and methoxy functional groups, making it a versatile intermediate in organic synthesis. Its reactive chloromethyl group enables further functionalization, while the methoxy substituent enhances electron density, influencing reactivity patterns. This compound is particularly useful in pharmaceutical and agrochemical applications, where its structural motifs are valuable for constructing complex molecules. The presence of two chlorine atoms at distinct positions offers selectivity in cross-coupling and nucleophilic substitution reactions. Its stability under standard conditions ensures reliable handling and storage, making it a practical choice for industrial and research applications requiring precise electrophilic or nucleophilic reactivity.
2-Chloro-1-(chloromethyl)-3-methoxybenzene structure
52516-44-6 structure
Product Name:2-Chloro-1-(chloromethyl)-3-methoxybenzene
CAS No:52516-44-6
MF:C8H8Cl2O
MW:191.054520606995
MDL:MFCD18393579
CID:1091734
PubChem ID:67023908
Update Time:2025-05-20

2-Chloro-1-(chloromethyl)-3-methoxybenzene Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-1-(chloromethyl)-3-methoxybenzene
    • 2-Chloro-3-methoxybenzyl chloride
    • CCA51644
    • G53460
    • SCHEMBL1415272
    • A913547
    • 52516-44-6
    • EN300-268106
    • MDL: MFCD18393579
    • Inchi: 1S/C8H8Cl2O/c1-11-7-4-2-3-6(5-9)8(7)10/h2-4H,5H2,1H3
    • InChI Key: FVHVMCMOQQBSBY-UHFFFAOYSA-N
    • SMILES: ClC1C(=CC=CC=1CCl)OC

Computed Properties

  • Exact Mass: 189.9952203g/mol
  • Monoisotopic Mass: 189.9952203g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 119
  • 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: 2.9
  • Topological Polar Surface Area: 9.2?2

2-Chloro-1-(chloromethyl)-3-methoxybenzene Security Information

  • Storage Condition:Sealed in dry,2-8°C

2-Chloro-1-(chloromethyl)-3-methoxybenzene Pricemore >>

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Additional information on 2-Chloro-1-(chloromethyl)-3-methoxybenzene

Comprehensive Overview of 2-Chloro-1-(chloromethyl)-3-methoxybenzene (CAS No. 52516-44-6)

2-Chloro-1-(chloromethyl)-3-methoxybenzene (CAS No. 52516-44-6) is a specialized organic compound widely utilized in pharmaceutical intermediates, agrochemical synthesis, and fine chemical production. Its molecular structure, featuring a chloromethyl group and a methoxy substituent, makes it a versatile building block for complex chemical reactions. Researchers and manufacturers frequently search for "2-Chloro-1-(chloromethyl)-3-methoxybenzene synthesis" or "CAS 52516-44-6 applications," highlighting its industrial relevance.

The compound’s unique reactivity stems from its benzene ring functionalization, enabling electrophilic aromatic substitution and nucleophilic displacement reactions. Recent trends in green chemistry have spurred interest in optimizing its synthesis to reduce environmental impact, with queries like "sustainable production of 2-Chloro-1-(chloromethyl)-3-methoxybenzene" gaining traction. Analytical techniques such as GC-MS and NMR are critical for purity verification, addressing common user concerns about "CAS 52516-44-6 purity standards."

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From a commercial perspective, suppliers emphasize "bulk procurement of CAS 52516-44-6" to meet industrial-scale demands. Storage recommendations often highlight stability under inert atmospheres, addressing safety-related queries without violating content restrictions. The compound’s spectral data (IR, UV-Vis) is also sought after for R&D validation, underscoring its multidisciplinary utility.

Emerging applications in material science, such as polymer modification, further expand its market potential. Discussions on "52516-44-6 derivatives" and "structure-activity relationships" dominate academic forums, while manufacturers prioritize "cost-effective synthesis routes." This dual focus on innovation and efficiency ensures sustained interest in 2-Chloro-1-(chloromethyl)-3-methoxybenzene across sectors.

To summarize, CAS No. 52516-44-6 exemplifies the intersection of chemistry and industry, with its chloro and methoxy functionalities driving diverse applications. By addressing user queries around synthesis, purity, and compliance, this overview bridges technical expertise with practical insights, enhancing its SEO performance and reader engagement.

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