Cas no 1226808-67-8 (6-Bromo-2-chloro-3-methylphenol)

6-Bromo-2-chloro-3-methylphenol is a halogenated phenolic compound with a molecular formula of C?H?BrClO. It features a bromo and chloro substitution on the aromatic ring, along with a methyl group, enhancing its reactivity and utility in organic synthesis. This compound is commonly employed as an intermediate in pharmaceuticals, agrochemicals, and specialty chemical production. Its distinct substitution pattern allows for selective functionalization, making it valuable for constructing complex molecular frameworks. The presence of halogen groups also contributes to its potential antimicrobial properties. Suitable for controlled reactions, it is typically handled under standard laboratory conditions to ensure stability and purity.
6-Bromo-2-chloro-3-methylphenol structure
1226808-67-8 structure
Product Name:6-Bromo-2-chloro-3-methylphenol
CAS No:1226808-67-8
MF:C7H6BrClO
MW:221.478940486908
MDL:MFCD16295099
CID:1038961
PubChem ID:53217010
Update Time:2025-05-27

6-Bromo-2-chloro-3-methylphenol Chemical and Physical Properties

Names and Identifiers

    • 6-Bromo-2-chloro-3-methylphenol
    • 1226808-67-8
    • AKOS015835380
    • BS-21301
    • DB-369067
    • MFCD16295099
    • BZB80867
    • E91114
    • Phenol, 6-bromo-2-chloro-3-methyl-
    • CS-0139901
    • SCHEMBL20137111
    • DTXSID90682117
    • MDL: MFCD16295099
    • Inchi: 1S/C7H6BrClO/c1-4-2-3-5(8)7(10)6(4)9/h2-3,10H,1H3
    • InChI Key: CRIAEOOHQOVEDR-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(C)=C(C=1O)Cl

Computed Properties

  • Exact Mass: 219.92900
  • Monoisotopic Mass: 219.92906g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 120
  • 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: 3.3
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23000
  • LogP: 3.11650

6-Bromo-2-chloro-3-methylphenol Customs Data

  • HS CODE:2908199090
  • Customs Data:

    China Customs Code:

    2908199090

    Overview:

    HS:2908199090 Derivatives of other phenols and phenolic alcohols containing only halogen substituents and their salts 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: 2908199090. derivatives of polyphenols or phenol-alcohols containing only halogen substituents and their salts. VAT:17.0%. tax rebate rate:9.0%. supervision conditions:None. MFN tariff:5.5%. general tariff:30.0%

6-Bromo-2-chloro-3-methylphenol Pricemore >>

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