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CAS 17012-31-6

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3-Chloro-5,6,7,8-tetrahydro-1-methyl-4-isoquinolinecarbonitrile

Description:
3-Chloro-5,6,7,8-tetrahydro-1-methyl-4-isoquinolinecarbonitrile is a chemical compound characterized by its isoquinoline structure, which features a bicyclic arrangement of carbon atoms. The presence of a chloro group at the 3-position and a cyano group at the 4-position contributes to its reactivity and potential applications in organic synthesis and medicinal chemistry. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its tetrahydro configuration indicates that it has undergone partial hydrogenation, which can influence its biological activity and pharmacological properties. The methyl group at the 1-position can also affect its lipophilicity and interaction with biological targets. As with many nitrogen-containing heterocycles, it may exhibit a range of biological activities, making it of interest in drug discovery and development. Safety data should be consulted for handling and usage, as halogenated compounds can pose health risks.
Formula:C11H11ClN2
InChI:InChI=1S/C11H11ClN2/c1-7-8-4-2-3-5-9(8)10(6-13)11(12)14-7/h2-5H2,1H3
InChI key:InChIKey=FYNCNVGZPPZNPY-UHFFFAOYSA-N
SMILES:C(#N)C1=C2C(=C(C)N=C1Cl)CCCC2
Synonyms:
  • 3-Chloro-1-methyl-5,6,7,8-tetrahydro-isoquinoline-4-carbonitrile
  • 4-Isoquinolinecarbonitrile, 3-chloro-5,6,7,8-tetrahydro-1-methyl-
  • 3-Chloro-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
  • 3-Chloro-4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinoline
  • 3-Chloro-5,6,7,8-tetrahydro-1-methyl-4-isoquinolinecarbonitrile
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