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CS-W001157 4
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6-Bromo-8-fluoro-3,4-dihydroisoquinolin-1(2H)-one

  • CAS No. 1242157-15-8

  • Cat. No. CS-0146226
  • Purity≥98%
  • MDL No.None

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

6-Bromo-8-fluoro-3,4-dihydroisoquinolin-1(2H)-one|CS-0146226

Structure of 1242157-15-8

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General Information

  • CAS No. 1242157-15-8
  • Cat. No. CS-0146226
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrFNO
  • Molecular Weight 244.06
  • Synonym(s) None
  • SMILES O=C1NCCC2=C1C(F)=CC(Br)=C2

Description

6-Bromo-8-fluoro-3,4-dihydroisoquinolin-1(2H)-one features a sterically constrained, electron-deficient core that enables direct functionalization at the 3,4-dihydroisoquinoline scaffold. This bench-stable heterocycle integrates seamlessly into medicinal chemistry campaigns targeting CNS agents and kinase inhibitors, offering enhanced metabolic stability and improved solubility profiles under standard conditions.

Application

6-Bromo-8-fluoro-3,4-dihydroisoquinolin-1(2H)-one serves as a versatile building block for the synthesis of bioactive heterocycles, enabling late-stage functionalization via palladium-catalyzed cross-coupling. The bromo and fluoro substituents provide orthogonal reactivity for sequential transformations, while the dihydroisoquinolinone core offers stability and compatibility with diverse reaction conditions. Its bench-stable solid form facilitates handling and purification in multi-step syntheses.

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   29.1
  • LogP   1.8741
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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