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CS-W001157 4
Total: USD 88.00

4,7-Difluoro-1H-indole

  • CAS No. 247564-55-2

  • Cat. No. CS-0131090
  • Purity≥97%
  • MDL No.MFCD01075214

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

4,7-Difluoro-1H-indole|CS-0131090

Structure of 247564-55-2

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General Information

  • CAS No. 247564-55-2
  • Cat. No. CS-0131090
  • Purity ≥97%
  • MDL No. MFCD01075214
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₂N
  • Molecular Weight 153.13
  • Synonym(s) 4,7-DIFLUOROINDOLE
  • SMILES FC1=CC=C(F)C2=C1NC=C2

Description

4,7-Difluoro-1H-indole features a fluorinated indole core with strategically positioned electron-withdrawing fluorine atoms at the 4 and 7 positions. This substitution pattern enhances metabolic stability and modulates electronic properties, making it valuable for medicinal chemistry applications. The molecule exhibits favorable solubility and bench-stability under standard conditions, enabling seamless integration into synthetic workflows.

Application

4,7-Difluoro-1H-indole serves as a valuable fluorinated building block for medicinal chemistry and heterocyclic synthesis. The ortho-fluorine substituents enhance metabolic stability and modulate electronic properties, enabling directed functionalization at C3 and C6 positions. Its bench-stable nature and compatibility with palladium-catalyzed cross-coupling reactions facilitate efficient construction of complex indole scaffolds in drug discovery workflows.

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   15.79
  • LogP   2.4461
  • H_Acceptors   0
  • H_Donors   1
  • Rotatable_Bonds   0

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