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CS-W001157 4
Total: USD 88.00

6-Bromo-2-methylisoindolin-1-one

  • CAS No. 1254319-51-1

  • Cat. No. CS-W022456
  • Purity≥97%
  • MDL No.None

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

6-Bromo-2-methylisoindolin-1-one|CS-W022456

Structure of 1254319-51-1

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General Information

  • CAS No. 1254319-51-1
  • Cat. No. CS-W022456
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈BrNO
  • Molecular Weight 226.07
  • Synonym(s) 6-bromo-2-methyl-3H-isoindol-1-one
  • SMILES O=C1N(C)CC2=C1C=C(Br)C=C2

Description

6-Bromo-2-methylisoindolin-1-one features a brominated isoindolinone core with a methyl group at the 2-position, enabling direct functionalization in cross-coupling reactions. This electron-deficient scaffold serves as a key intermediate in synthesizing bioactive molecules and pharmaceuticals.

Application

6-Bromo-2-methylisoindolin-1-one serves as a versatile building block in medicinal chemistry, enabling direct functionalization at the C6 position via palladium-catalyzed cross-coupling reactions. The bromo group exhibits high reactivity in Suzuki, Stille, and Negishi couplings, while the isoindolinone core provides a rigid, electron-deficient scaffold suitable for target-oriented synthesis. Bench-stable and readily purified by flash chromatography, it functions as a key intermediate in the construction of bioactive heterocycles and API precursors.

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   2.0347
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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