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CS-W001157 4
Total: USD 88.00

7-(Trifluoromethyl)-1H-indole

  • CAS No. 172217-02-6

  • Cat. No. CS-W005730
  • Purity≥98%
  • MDL No.MFCD09954769

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

7-(Trifluoromethyl)-1H-indole|CS-W005730

Structure of 172217-02-6

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General Information

  • CAS No. 172217-02-6
  • Cat. No. CS-W005730
  • Purity ≥98%
  • MDL No. MFCD09954769
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆F₃N
  • Molecular Weight 185.15
  • Synonym(s) 1H-indole, 7-(trifluoromethyl)-
  • SMILES FC(C1=CC=CC2=C1NC=C2)(F)F

Description

7-(Trifluoromethyl)-1H-indole features a trifluoromethyl group at the 7-position of the indole core, conferring enhanced electron-withdrawing character and metabolic stability. This substitution pattern improves solubility in organic media while preserving the heterocycle’s reactivity for C–H functionalization and transition-metal-catalyzed coupling reactions. The molecule serves as a valuable scaffold in medicinal chemistry and materials science.

Application

7-(Trifluoromethyl)-1H-indole serves as a valuable building block in medicinal chemistry, enabling direct incorporation of a strongly electron-withdrawing trifluoromethyl group at the C7 position of the indole core. Its bench-stable nature and compatibility with standard cross-coupling reactions facilitate efficient functionalization for drug discovery applications.

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   15.79
  • LogP   3.1867
  • H_Acceptors   0
  • H_Donors   1
  • Rotatable_Bonds   0

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