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CS-W001157 4
Total: USD 88.00

1-(5-Bromo-1H-indazol-3-yl)ethan-1-one

  • CAS No. 886363-74-2

  • Cat. No. CS-0052868
  • Molecule weight239.07
  • Purity≥97%
  • MDL No.None

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

1-(5-Bromo-1H-indazol-3-yl)ethan-1-one|CS-0052868

Structure of 886363-74-2

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General Information

  • CAS No. 886363-74-2
  • Cat. No. CS-0052868
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrN₂O
  • Molecular Weight 239.07
  • Synonym(s) Ethanone, 1-(5-bromo-1H-indazol-3-yl)-
  • SMILES CC(=O)C1=NNC2=C1C=C(Br)C=C2

Description

This 1-(5-Bromo-1H-indazol-3-yl)ethan-1-one features a brominated indazolone core with a ketone-functionalized ethyl side chain, enabling direct incorporation into C–C bond-forming reactions. The electron-deficient aromatic system supports efficient coupling processes under standard conditions.

Application

1-(5-Bromo-1H-indazol-3-yl)ethan-1-one serves as a versatile building block in medicinal chemistry, enabling direct functionalization at the indazole core via electrophilic substitution or transition-metal-catalyzed coupling. The ketone group provides a handle for reductive amination, enolate formation, or nucleophilic addition, while the bromine facilitates palladium-catalyzed cross-coupling reactions. Its bench-stable nature and compatibility with common protecting groups support efficient synthesis of complex heterocyclic scaffolds.

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   45.75
  • LogP   2.528
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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