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CAS 1256463-61-2

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8-Chloro-5-isoquinolinecarbonitrile

Description:
8-Chloro-5-isoquinolinecarbonitrile is a chemical compound characterized by its isoquinoline structure, which is a bicyclic aromatic compound. The presence of a chlorine atom at the 8-position and a cyano group (-C≡N) at the 5-position contributes to its unique reactivity and properties. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents, depending on the specific solvent's polarity. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the presence of the isoquinoline moiety, which is known for various biological activities. Additionally, the chlorine substituent can enhance the compound's lipophilicity and influence its interaction with biological targets. As with many nitriles, it may also exhibit toxicity and should be handled with care in laboratory settings. Overall, 8-Chloro-5-isoquinolinecarbonitrile is of interest for its potential applications in drug discovery and development.
Formula:C10H5ClN2
InChI:InChI=1S/C10H5ClN2/c11-10-2-1-7(5-12)8-3-4-13-6-9(8)10/h1-4,6H
InChI key:InChIKey=HFTNMUIHUJISBT-UHFFFAOYSA-N
SMILES:C(#N)C=1C2=C(C(Cl)=CC1)C=NC=C2
Synonyms:
  • 5-Isoquinolinecarbonitrile, 8-chloro-
  • 8-Chloro-5-isoquinolinecarbonitrile
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