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7-(Trifluoromethyl)-2,3-dihydro-1H-inden-1-one

  • CAS No. 1003048-68-7

  • Cat. No. CS-0101629
  • Purity≥98%
  • MDL No.None

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

7-(Trifluoromethyl)-2,3-dihydro-1H-inden-1-one|CS-0101629

Structure of 1003048-68-7

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General Information

  • CAS No. 1003048-68-7
  • Cat. No. CS-0101629
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇F₃O
  • Molecular Weight 200.16
  • Synonym(s) 7-(Trifluoromethyl)-1-indanone
  • SMILES O=C1CCC2=C1C(C(F)(F)F)=CC=C2

Description

7-(Trifluoromethyl)-2,3-dihydro-1H-inden-1-one features a trifluoromethyl group at the 7-position of a dihydroindenone scaffold, imparting enhanced electron-withdrawing character and metabolic stability. This moiety integrates readily into pharmaceutical intermediates and functional materials due to its steric profile and compatibility with diverse synthetic transformations under standard conditions.

Application

7-(Trifluoromethyl)-2,3-dihydro-1H-inden-1-one serves as a valuable building block in medicinal chemistry, enabling efficient access to fluorinated heterocyclic scaffolds. Its trifluoromethyl group enhances metabolic stability and modulates lipophilicity, while the enone functionality supports diverse transformations including Michael additions and conjugate reductions. The compound exhibits good bench stability and compatibility with standard synthetic workflows, facilitating incorporation into complex molecular architectures.

Synthesis

  • Route1
    • 3-(3-(Trifluoromethyl)phenyl)propanoic acid Cinacalcet Impurity|CS-0214029
      585-50-2
    • ~%
    • In-stock
      7-(Trifluoromethyl)-2,3-dihydro-1H-inden-1-one|CS-0101629
      1003048-68-7

    References

    • EP2042480 A1, ; Page/Page column 13 ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.8343
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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