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CS-W001157 4
Total: USD 88.00

7-Bromo-1-indanone

  • CAS No. 125114-77-4

  • Cat. No. CS-D0687
  • Purity≥98%
  • MDL No.MFCD06796574

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

7-Bromo-1-indanone|CS-D0687

Structure of 125114-77-4

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General Information

  • CAS No. 125114-77-4
  • Cat. No. CS-D0687
  • Purity ≥98%
  • MDL No. MFCD06796574
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrO
  • Molecular Weight 211.06
  • Synonym(s) 7-Bromo-2,3-dihydroinden-1-one
  • SMILES O=C(CC1)C(C1=CC=C2)=C2Br

Description

7-Bromo-2,3-dihydroinden-1-one is a brominated indenone derivative featuring a reactive ketone group and a pendant bromine at the 7-position. This configuration enables direct functionalization in cross-coupling reactions and facilitates integration into complex molecular architectures under mild conditions.

Application

7-Bromo-2,3-dihydroinden-1-one serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted indenones and fused heterocyclic systems. Its bromine substituent facilitates palladium-catalyzed cross-coupling reactions, while the ketone group supports nucleophilic additions and condensation processes. The compound exhibits good bench stability and is readily purified by recrystallization, making it well-suited for iterative synthesis in medicinal chemistry and process development workflows.

Synthesis

  • Route1

    References

    • Nguyen, Phong; Corpuz, Evelyn; Heidelbaugh, Todd M.; Chow, Ken; Garst, Michael E. Journal of Organic Chemistry, 2003 , vol. 68, # 26 p. 10195 - 10198
  • Route2
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    • In-stock
      7-Bromo-1-indanone|CS-D0687
      125114-77-4

    References

    • Nguyen, Phong; Corpuz, Evelyn; Heidelbaugh, Todd M.; Chow, Ken; Garst, Michael E. Journal of Organic Chemistry, 2003 , vol. 68, # 26 p. 10195 - 10198
  • Route3

    References

    • Tetrahedron, , vol. 63, # 2 p. 389 - 395

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

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.578
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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