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CAS 25889-38-7

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4-Chloro-2-nitro-1-(trifluoromethyl)benzene

Description:
4-Chloro-2-nitro-1-(trifluoromethyl)benzene, with the CAS number 25889-38-7, is an aromatic compound characterized by the presence of a chloro group, a nitro group, and a trifluoromethyl group attached to a benzene ring. This compound typically appears as a pale yellow solid and is known for its relatively high stability due to the resonance of the aromatic system. The chloro and nitro substituents are electron-withdrawing groups, which can influence the compound's reactivity and polarity. The trifluoromethyl group significantly enhances the lipophilicity and can affect the compound's biological activity. It is often used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Due to the presence of halogen and nitro groups, this compound may exhibit toxicity and environmental persistence, necessitating careful handling and disposal. Its physical and chemical properties, such as solubility and melting point, can vary based on the specific conditions and purity of the sample.
Formula:C7H3ClF3NO2
InChI:InChI=1S/C7H3ClF3NO2/c8-4-1-2-5(7(9,10)11)6(3-4)12(13)14/h1-3H
InChI key:InChIKey=DDNRGAUZMIFKQS-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(C(F)(F)F)C=CC(Cl)=C1
Synonyms:
  • Benzene, 4-chloro-2-nitro-1-(trifluoromethyl)-
  • 4-Chloro-2-nitro-1-(trifluoromethyl)benzene
  • 4-Chloro-2-nitrobenzotrifluoride
  • Toluene, 4-chloro-α,α,α-trifluoro-2-nitro-
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