Cas no 196519-58-1 (Phenol, 4-fluoro-2,5-dimethyl-)

Phenol, 4-fluoro-2,5-dimethyl-, is a fluorinated aromatic compound featuring a phenol core substituted with a fluorine atom at the para position and methyl groups at the 2- and 5-positions. This structural modification enhances its reactivity and selectivity in organic synthesis, particularly in electrophilic aromatic substitution and coupling reactions. The fluorine atom introduces electron-withdrawing effects, improving stability and influencing the compound's electronic properties, while the methyl groups contribute steric hindrance, fine-tuning its reactivity. It serves as a valuable intermediate in pharmaceuticals, agrochemicals, and specialty materials, offering precise control over molecular design. Its high purity and well-defined structure make it suitable for research and industrial applications requiring tailored aromatic building blocks.
Phenol, 4-fluoro-2,5-dimethyl- structure
196519-58-1 structure
Product Name:Phenol, 4-fluoro-2,5-dimethyl-
CAS No:196519-58-1
MF:C8H9FO
MW:140.154865980148
CID:3869191
PubChem ID:22627623
Update Time:2025-07-02

Phenol, 4-fluoro-2,5-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Phenol, 4-fluoro-2,5-dimethyl-
    • 4-Fluoro-2,5-dimethylphenol
    • SCHEMBL7724120
    • SZAAQEQSQLOKQW-UHFFFAOYSA-N
    • DTXSID301309850
    • 196519-58-1
    • MFCD23111064
    • Inchi： 1S/C8H9FO/c1-5-4-8(10)6(2)3-7(5)9/h3-4,10H,1-2H3
    • InChI Key： SZAAQEQSQLOKQW-UHFFFAOYSA-N
    • SMILES： FC1=CC(C)=C(C=C1C)O

Computed Properties

  • Exact Mass: 140.064
  • Monoisotopic Mass: 140.064
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 116
  • 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
  • Topological Polar Surface Area: 20.2A^2
  • XLogP3: 2.4

Phenol, 4-fluoro-2,5-dimethyl- Pricemore >>

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SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd.
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SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
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