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CAS 37812-51-4

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4-(Morpholinomethyl)benzonitrile

Description:
4-(Morpholinomethyl)benzonitrile, with the CAS number 37812-51-4, is an organic compound characterized by the presence of a benzonitrile moiety substituted with a morpholinomethyl group. This compound typically exhibits a white to off-white solid appearance and is soluble in polar organic solvents. The morpholine ring contributes to its potential as a pharmacophore in medicinal chemistry, often enhancing biological activity due to its ability to engage in hydrogen bonding and interact with biological targets. The nitrile functional group (-C≡N) is known for its reactivity, allowing for further chemical modifications. Additionally, the compound may possess various functional properties, including potential applications in drug development, particularly in the fields of neuropharmacology and cancer research. Its structural features suggest it may exhibit lipophilicity, which can influence its bioavailability and pharmacokinetics. As with many organic compounds, safety data should be consulted to understand its handling and toxicity profiles in laboratory settings.
Formula:C12H14N2O
InChI:InChI=1S/C12H14N2O/c13-9-11-1-3-12(4-2-11)10-14-5-7-15-8-6-14/h1-4H,5-8,10H2
InChI key:InChIKey=BCZLYNFDOJXWGN-UHFFFAOYSA-N
SMILES:C(C1=CC=C(C#N)C=C1)N2CCOCC2
Synonyms:
  • 4-(Morpholinomethyl)benzonitrile
  • 4-(4-Morpholinylmethyl)benzonitrile
  • Benzonitrile, 4-(4-morpholinylmethyl)-
  • 4-(Morpholin-4-ylmethyl)benzonitrile
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