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CS-W001157 4
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1-(5-Bromoindolin-1-yl)ethan-1-one

  • CAS No. 22190-38-1

  • Cat. No. CS-0128914
  • Purity≥95%
  • MDL No.MFCD00056017

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

1-(5-Bromoindolin-1-yl)ethan-1-one|CS-0128914

Structure of 22190-38-1

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General Information

  • CAS No. 22190-38-1
  • Cat. No. CS-0128914
  • Purity ≥95%
  • MDL No. MFCD00056017
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀BrNO
  • Molecular Weight 240.10
  • Synonym(s) 1-acetyl-5-bromoindoline crystalline
  • SMILES CC(N1CCC2=C1C=CC(Br)=C2)=O

Description

1-(5-Bromoindolin-1-yl)ethan-1-one features a brominated indoline core linked to an acetyl group, delivering a robust scaffold for medicinal chemistry. This compound integrates readily into diverse synthetic pathways, offering enhanced stability and compatibility with transition-metal-catalyzed transformations. Its electron-deficient aryl moiety supports efficient coupling reactions, enabling rapid access to functionalized heterocycles in drug discovery and materials science applications.

Application

1-(5-Bromoindolin-1-yl)ethan-1-one serves as a versatile building block for the synthesis of brominated indoline derivatives, enabling direct functionalization at the C5 position. Its ketone functionality facilitates nucleophilic additions and condensation reactions, while the bromine atom supports palladium-catalyzed cross-coupling transformations. The compound exhibits good bench stability and is compatible with standard purification protocols, making it suitable for medicinal chemistry campaigns and API intermediate development.

Safety Information

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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   20.31
  • LogP   2.3581
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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