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CS-W001157 4
Total: USD 88.00

2-Fluoro-5-methylphenol

  • CAS No. 63762-79-8

  • Cat. No. CS-W008056
  • Purity≥98%
  • MDL No.MFCD00190101

*For research and further manufacturing use only, not for direct human use.

2-Fluoro-5-methylphenol|CS-W008056

Structure of 63762-79-8

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General Information

  • CAS No. 63762-79-8
  • Cat. No. CS-W008056
  • Purity ≥98%
  • MDL No. MFCD00190101
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇FO
  • Molecular Weight 126.13
  • Synonym(s) 6-Fluoro-m-cresol (OH=1)
  • SMILES OC1=CC(C)=CC=C1F

Description

2-Fluoro-5-methylphenol features a fluorine atom at the ortho position and a methyl group at the para position relative to the phenolic hydroxyl, creating a uniquely electron-deficient aromatic system. This combination imparts enhanced reactivity in electrophilic substitution and improved metabolic stability, making it valuable for pharmaceutical intermediates and agrochemical synthesis.

Application

2-Fluoro-5-methylphenol serves as a valuable building block in medicinal chemistry, enabling the synthesis of fluorinated aromatic scaffolds via standard coupling reactions. Its ortho-fluoro and meta-methyl substituents provide directed functionalization potential and enhanced metabolic stability. The compound exhibits good bench stability, facilitates straightforward purification, and functions effectively in Suzuki-Miyaura and Ullmann-type transformations.

Synthesis

  • Route1
    • null|null
      108-39-4
    • ~44%
    • In-stock
      4-Fluoro-3-methylphenol|CS-W002208
      452-70-0
    • In-stock
      2-Fluoro-5-methylphenol|CS-W008056
      63762-79-8

    References

    • Journal of the American Chemical Society, , vol. 109, # 23 p. 7194 - 7196
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 22, # 1 p. 63 - 69
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 22, # 1 p. 63 - 69

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   1.83972
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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