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CAS 28195-00-8

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4-Methyl-2-[(1-methylethyl)amino]benzonitrile

Description:
4-Methyl-2-[(1-methylethyl)amino]benzonitrile, with the CAS number 28195-00-8, is an organic compound characterized by its aromatic structure and the presence of both a nitrile and an amine functional group. This compound features a benzene ring substituted with a methyl group and an isopropylamino group, which contributes to its unique chemical properties. It is typically a solid at room temperature and may exhibit moderate solubility in organic solvents, depending on the specific conditions. The presence of the nitrile group suggests potential reactivity in nucleophilic addition reactions, while the amine group can participate in hydrogen bonding and may influence the compound's basicity. This compound is of interest in various fields, including medicinal chemistry, where it may serve as a precursor or intermediate in the synthesis of pharmaceuticals. Safety data should be consulted for handling and storage, as with any chemical substance, to ensure proper precautions are taken.
Formula:C11H14N2
InChI:InChI=1S/C11H14N2/c1-8(2)13-11-6-9(3)4-5-10(11)7-12/h4-6,8,13H,1-3H3
InChI key:InChIKey=HVKRBGJBJXDAGA-UHFFFAOYSA-N
SMILES:N(C(C)C)C1=C(C#N)C=CC(C)=C1
Synonyms:
  • 2-Isopropylamino-p-tolunitrile
  • 4-Methyl-2-(Propan-2-Ylamino)Benzonitrile
  • 4-Methyl-2-[(1-methylethyl)amino]benzonitrile
  • Benzonitrile, 4-methyl-2-[(1-methylethyl)amino]-
  • p-Tolunitrile, 2-(isopropylamino)-
  • 2-(Isopropylamino)-4-methylbenzonitrile
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