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CAS 1801-10-1

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3-(Trifluoromethyl)benzamide

Description:
3-(Trifluoromethyl)benzamide is an organic compound characterized by the presence of a benzene ring substituted with a trifluoromethyl group and an amide functional group. Its molecular structure features a benzene ring with a trifluoromethyl group (-CF3) at the meta position relative to the amide group (-C(=O)NH2). This compound is typically a white to off-white solid at room temperature and is known for its relatively high stability due to the strong C-F bonds in the trifluoromethyl group. The presence of the trifluoromethyl group imparts unique electronic properties, enhancing the compound's lipophilicity and potentially influencing its reactivity and interactions in biological systems. 3-(Trifluoromethyl)benzamide is often utilized in various chemical syntheses and may serve as an intermediate in the production of pharmaceuticals and agrochemicals. Its CAS number, 1801-10-1, is a unique identifier used for regulatory and safety purposes. As with many fluorinated compounds, it is important to handle it with care due to potential environmental and health impacts.
Formula:C8H6F3NO
InChI:InChI=1S/C8H6F3NO/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H2,12,13)
InChI key:InChIKey=XBGXGCOLWCMVOI-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(C(N)=O)=CC=C1
Synonyms:
  • Benzamide, 3-(trifluoromethyl)-
  • alpha,alpha,alpha-Trifluoro-m-toluamide
  • m-Toluamide, α,α,α-trifluoro-
  • m-Trifluoromethylbenzamide
  • α,α,α-Trifluoro-m-toluamide
  • 3-(Trifluoromethyl)benzamide
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