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CAS 85692-25-7

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3-(3,5-dimethylphenyl)-3-oxopropanenitrile

Description:
3-(3,5-Dimethylphenyl)-3-oxopropanenitrile, with the CAS number 85692-25-7, is an organic compound characterized by its functional groups and structural features. It contains a nitrile group (-C≡N) and a ketone group (C=O) within a propanone framework, which contributes to its reactivity and potential applications in organic synthesis. The presence of the 3,5-dimethylphenyl substituent enhances its hydrophobic character and may influence its solubility in various organic solvents. This compound is typically a solid at room temperature and may exhibit moderate stability under standard conditions. Its chemical properties, such as reactivity and interaction with other substances, are influenced by the electron-withdrawing nature of the nitrile group and the steric effects of the dimethylphenyl moiety. Due to these characteristics, it may be of interest in pharmaceutical research, agrochemicals, or as an intermediate in organic synthesis. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C11H11NO
InChI:InChI=1/C11H11NO/c1-8-5-9(2)7-10(6-8)11(13)3-4-12/h5-7H,3H2,1-2H3
SMILES:Cc1cc(C)cc(c1)C(=O)CC#N
Synonyms:
  • Benzenepropanenitrile, 3,5-Dimethyl-Β-Oxo-
  • 3-(3,5-Dimethylphenyl)-3-oxopropanenitrile
  • 3,5-DIMETHYLBENZOYLACETONITRILE
  • UKRORGSYN-BB BBV-073949
  • 3-(3,5-DIMETHYLPHENYL)-3-OXOPROPIONITRILE
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