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CS-W001157 4
Total: USD 88.00

6-Fluoro-1H-indole-3-carboxylic acid

  • CAS No. 23077-44-3

  • Cat. No. CS-W006480
  • Purity≥97%
  • MDL No.MFCD06203359

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

6-Fluoro-1H-indole-3-carboxylic acid|CS-W006480

Structure of 23077-44-3

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General Information

  • CAS No. 23077-44-3
  • Cat. No. CS-W006480
  • Purity ≥97%
  • MDL No. MFCD06203359
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆FNO₂
  • Molecular Weight 179.15
  • Synonym(s) 6-Fluor-3-indolcarbonsaeure
  • SMILES O=C(C1=CNC2=C1C=CC(F)=C2)O

Description

6-Fluoro-1H-indole-3-carboxylic acid features a fluorinated indole core with a carboxylic acid group at the 3-position, enabling direct conjugation or derivatization in synthetic workflows. The electron-withdrawing fluorine substituent enhances metabolic stability and modulates electronic properties, making this scaffold valuable for medicinal chemistry and bioactive molecule development.

Application

6-Fluoro-1H-indole-3-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of biologically active indole derivatives. Its fluorinated aromatic ring enhances metabolic stability and modulates electronic properties, while the carboxylic acid group facilitates direct coupling reactions or derivatization. The compound exhibits good bench stability and compatibility with standard peptide and heterocyclic coupling protocols, making it well-suited for parallel library synthesis and API development.

Synthesis

  • Route1
    • In-stock
      6-Fluoroindole|CS-W002271
      399-51-9
    • null|null
      407-25-0
    • ~%
    • In-stock
      6-Fluoro-1H-indole-3-carboxylic acid|CS-W006480
      23077-44-3

    References

    • ChemMedChem, , vol. 7, # 11 p. 1915 - 1920
  • Route2

    References

    • CrystEngComm, , vol. 15, # 37 p. 7490 - 7497
  • Route3

    References

    • CrystEngComm, , vol. 15, # 37 p. 7490 - 7497

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

Quality Control

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Computational Chemistry Data

  • TPSA   53.09
  • LogP   2.0052
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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