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CAS 867330-04-9

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2-[(Diethylamino)methyl]benzonitrile

Description:
2-[(Diethylamino)methyl]benzonitrile, with the CAS number 867330-04-9, is an organic compound characterized by its structure, which features a benzonitrile moiety substituted with a diethylamino group. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. It is known for its potential applications in medicinal chemistry and as an intermediate in the synthesis of various pharmaceuticals. The presence of the diethylamino group imparts basic properties to the molecule, allowing it to engage in hydrogen bonding and interact with biological systems. Additionally, the nitrile functional group contributes to its reactivity, making it a useful building block in organic synthesis. Safety data indicates that, like many organic compounds, it should be handled with care, as it may pose health risks if inhaled or ingested. Proper storage and handling procedures are essential to ensure safety in laboratory environments.
Formula:C12H16N2
InChI:InChI=1S/C12H16N2/c1-3-14(4-2)10-12-8-6-5-7-11(12)9-13/h5-8H,3-4,10H2,1-2H3
InChI key:InChIKey=RXOWGZSDKIPFGO-UHFFFAOYSA-N
SMILES:C(N(CC)CC)C1=C(C#N)C=CC=C1
Synonyms:
  • 2-[(Diethylamino)methyl]benzonitrile
  • Benzonitrile, 2-[(diethylamino)methyl]-
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