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CAS 904311-38-2

:

4-methylsulfonyl-3-(trifluoromethyl)benzonitrile

Description:
4-Methylsulfonyl-3-(trifluoromethyl)benzonitrile, identified by its CAS number 904311-38-2, is an organic compound characterized by the presence of a benzonitrile core substituted with a methylsulfonyl group and a trifluoromethyl group. This compound typically exhibits a solid state at room temperature and is known for its relatively high stability due to the presence of the nitrile functional group, which contributes to its chemical inertness. The trifluoromethyl group enhances its lipophilicity and can influence its biological activity, making it of interest in pharmaceutical research. Additionally, the methylsulfonyl group can participate in various chemical reactions, potentially serving as a site for further functionalization. The compound's unique structure may impart specific properties such as solubility in organic solvents and potential reactivity under certain conditions. Overall, 4-methylsulfonyl-3-(trifluoromethyl)benzonitrile is a compound of interest in synthetic organic chemistry and material science, particularly in the development of agrochemicals and pharmaceuticals.
Formula:C9H6F3NO2S
InChI:InChI=1/C9H6F3NO2S/c1-16(14,15)8-3-2-6(5-13)4-7(8)9(10,11)12/h2-4H,1H3
SMILES:CS(=O)(=O)c1ccc(cc1C(F)(F)F)C#N
Synonyms:
  • Benzonitrile, 4-(Methylsulfonyl)-3-(Trifluoromethyl)-
  • 4-(Methylsulfonyl)-3-(trifluoromethyl)benzonitrile
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