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CAS 1099597-70-2

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2-Chloro-1,4-difluoro-3-(trifluoromethyl)benzene

Description:
2-Chloro-1,4-difluoro-3-(trifluoromethyl)benzene, with the CAS number 1099597-70-2, is an aromatic compound characterized by the presence of multiple halogen substituents on a benzene ring. This compound features a chlorine atom and two fluorine atoms at the 1 and 4 positions, respectively, along with a trifluoromethyl group (-CF3) at the 3 position. The presence of these electronegative halogens significantly influences its chemical properties, including increased reactivity and polarity. The compound is likely to exhibit low volatility and high stability under standard conditions due to the strong C-F and C-Cl bonds. Its unique structure may impart specific characteristics such as potential applications in agrochemicals, pharmaceuticals, or as intermediates in organic synthesis. Additionally, the presence of multiple fluorine atoms can enhance lipophilicity, which may affect its behavior in biological systems. Safety data should be consulted for handling and exposure guidelines, as halogenated compounds can pose environmental and health risks.
Formula:C7H2ClF5
InChI:InChI=1S/C7H2ClF5/c8-6-4(10)2-1-3(9)5(6)7(11,12)13/h1-2H
InChI key:InChIKey=XXZWVTAXADIDKW-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C(Cl)C(F)=CC=C1F
Synonyms:
  • 2-Chloro-1,4-difluoro-3-(trifluoromethyl)benzene
  • Benzene, 2-chloro-1,4-difluoro-3-(trifluoromethyl)-
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