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CAS 320-47-8

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4-Nitro-2-(trifluoromethyl)benzonitrile

Description:
4-Nitro-2-(trifluoromethyl)benzonitrile, with the CAS number 320-47-8, is an organic compound characterized by its aromatic structure, which includes a nitro group and a trifluoromethyl group attached to a benzene ring. This compound typically appears as a crystalline solid and is known for its relatively high stability due to the presence of the electron-withdrawing nitro and trifluoromethyl groups, which influence its reactivity and solubility. It is often used in organic synthesis and as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of the nitrile functional group contributes to its polar nature, affecting its solubility in different solvents. Additionally, the trifluoromethyl group enhances its lipophilicity, making it useful in applications that require specific interactions with biological systems. Safety data indicates that it should be handled with care, as it may pose health risks upon exposure. Overall, 4-Nitro-2-(trifluoromethyl)benzonitrile is a valuable compound in chemical research and industrial applications.
Formula:C8H3F3N2O2
InChI:InChI=1/C8H3F3N2O2/c9-8(10,11)7-3-6(13(14)15)2-1-5(7)4-12/h1-3H
InChI key:AGKQJEFSEQHGTA-UHFFFAOYSA-N
SMILES:c1cc(cc(c1C#N)C(F)(F)F)N(=O)=O
Synonyms:
  • 2-Cyano-5-nitrobenzotrifluoride
  • 2-Trifluoromethyl-4-Nitrobenzonitrile
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