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CS-W001157 4
Total: USD 88.00

3-Fluoro-4-methylbenzaldehyde

  • CAS No. 177756-62-6

  • Cat. No. CS-W018316
  • Purity≥96%
  • MDL No.MFCD01631532

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

3-Fluoro-4-methylbenzaldehyde|CS-W018316

Structure of 177756-62-6

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General Information

  • CAS No. 177756-62-6
  • Cat. No. CS-W018316
  • Purity ≥96%
  • MDL No. MFCD01631532
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇FO
  • Molecular Weight 138.14
  • Synonym(s) Benzaldehyde, 3-fluoro-4-methyl- (9CI)
  • SMILES O=CC1=CC=C(C)C(F)=C1

Description

3-Fluoro-4-methylbenzaldehyde features a fluorinated aromatic ring paired with a methyl group and aldehyde functionality, enabling selective coupling reactions in pharmaceutical synthesis. This electron-deficient aldehyde integrates readily into complex scaffolds under standard conditions.

Application

3-Fluoro-4-methylbenzaldehyde serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted benzimidazoles, arylamines, and heterocyclic scaffolds. Its fluorinated aromatic ring enhances metabolic stability and modulates electronic properties, while the aldehyde functionality facilitates condensation reactions, reductive amination, and Ullmann-type couplings. Bench-stable and compatible with common protecting group strategies, it offers predictable reactivity in multi-step syntheses.

Synthesis

  • Route1

    References

    • Chambers, Richard D.; Sandford, Graham; Trmcic, Jelena; Okazoe, Takashi Organic Process Research and Development, 2008 , vol. 12, # 2 p. 339 - 344
  • Route2

    References

    • Chambers, Richard D.; Hutchinson, John; Sparrowhawk, Matthew E.; Sandford, Graham; Moilliet, John S.; Thomson, Julie Journal of Fluorine Chemistry, 2000 , vol. 102, # 1-2 p. 169 - 173
  • Route3
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      95-52-3
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      201230-82-2
    • ~%
    • In-stock
      4-Fluoro-3-methylbenzaldehyde|CS-W007668
      135427-08-6
    • In-stock
      3-Fluoro-4-methylbenzaldehyde|CS-W018316
      177756-62-6

    References

    • EP1544189 A1, ; Page/Page column 5-6 ;

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   17.07
  • LogP   1.94662
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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