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CAS 36963-50-5

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4-Bromo-3(2H)-isoquinolinone

Description:
4-Bromo-3(2H)-isoquinolinone is a chemical compound characterized by its isoquinolinone structure, which features a bromine atom at the 4-position of the isoquinoline ring. This compound typically exhibits a pale yellow to brownish color and is soluble in organic solvents such as dimethyl sulfoxide (DMSO) and ethanol, but may have limited solubility in water. The presence of the bromine substituent can influence its reactivity and biological activity, making it of interest in medicinal chemistry and organic synthesis. 4-Bromo-3(2H)-isoquinolinone may serve as a precursor or intermediate in the synthesis of various pharmaceuticals or bioactive compounds. Its molecular structure contributes to its potential applications in research, particularly in the development of compounds with antimicrobial or anticancer properties. As with many chemical substances, proper handling and safety precautions are essential due to potential toxicity and reactivity.
Formula:C9H6BrNO
InChI:InChI=1S/C9H6BrNO/c10-8-7-4-2-1-3-6(7)5-11-9(8)12/h1-5H,(H,11,12)
InChI key:InChIKey=POFWHUZLFZOBFX-UHFFFAOYSA-N
SMILES:BrC1=C2C(=CNC1=O)C=CC=C2
Synonyms:
  • 3(2H)-Isoquinolinone, 4-bromo-
  • 4-Bromo-3(2H)-isoquinolinone
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