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7-Bromo-5-hydroxy-2,3-dihydro-1H-inden-1-one

  • CAS No. 1199783-02-2

  • Cat. No. CS-0254659
  • Purity≥95%
  • MDL No.None

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

7-Bromo-5-hydroxy-2,3-dihydro-1H-inden-1-one|CS-0254659

Structure of 1199783-02-2

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General Information

  • CAS No. 1199783-02-2
  • Cat. No. CS-0254659
  • Purity ≥95%
  • MDL No. None
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrO₂
  • Molecular Weight 227.05
  • Synonym(s) None
  • SMILES O=C1CCC2=C1C(Br)=CC(O)=C2

Description

7-Bromo-5-hydroxy-2,3-dihydro-1H-inden-1-one features a brominated indenone core with a hydroxyl group at the 5-position, offering a reactive handle for downstream functionalization. The molecule combines electrophilic bromine and polar hydroxyl functionalities within a stable, fused bicyclic scaffold. This structure supports efficient coupling reactions in synthetic organic chemistry, particularly in transition-metal-catalyzed transformations. Its bench-stable nature enables straightforward handling under standard laboratory conditions.

Application

7-Bromo-5-hydroxy-2,3-dihydro-1H-inden-1-one serves as a versatile building block for the synthesis of biologically active indenone derivatives. Its bromo and hydroxyl functionalities enable diverse downstream transformations, including Suzuki-Miyaura coupling and oxidation reactions. The molecule exhibits good bench stability and facilitates efficient purification, making it well-suited 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 : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.2836
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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