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CAS 386-70-9

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1-Chloro-2-nitro-3-(trifluoromethyl)benzene

Description:
1-Chloro-2-nitro-3-(trifluoromethyl)benzene, with the CAS number 386-70-9, is an aromatic compound characterized by the presence of a chlorine atom, a nitro group, and a trifluoromethyl group attached to a benzene ring. This compound typically appears as a pale yellow to light brown liquid or solid, depending on the temperature. It is known for its relatively low solubility in water but is soluble in organic solvents such as acetone and ether. The presence of the trifluoromethyl group imparts unique electronic properties, enhancing its reactivity and making it useful in various chemical syntheses. The nitro group contributes to its electrophilic character, while the chlorine atom can participate in substitution reactions. This compound is often utilized in the synthesis of pharmaceuticals, agrochemicals, and other organic compounds. Due to its chemical structure, it may exhibit toxicity and environmental persistence, necessitating careful handling and disposal in accordance with safety regulations.
Formula:C7H3ClF3NO2
InChI:InChI=1S/C7H3ClF3NO2/c8-5-3-1-2-4(7(9,10)11)6(5)12(13)14/h1-3H
InChI key:InChIKey=ZECBOHAXBNGMSP-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(C(F)(F)F)C=CC=C1Cl
Synonyms:
  • 1-Chloro-2-Nitro-3-(Trifluoromethyl)Benzene
  • Benzene, 1-chloro-2-nitro-3-(trifluoromethyl)-
  • Toluene, 3-chloro-2-nitro-α,α,α-trifluoro-
  • 3-Chloro-2-nitrobenzotrifluoride
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