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CAS 63878-71-7

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2-(Difluoromethyl)-1-fluoro-4-nitrobenzene

Description:
2-(Difluoromethyl)-1-fluoro-4-nitrobenzene, with the CAS number 63878-71-7, is an organic compound characterized by its aromatic structure, which includes a nitro group and multiple fluorine substituents. This compound features a benzene ring substituted at the 1-position with a fluorine atom, at the 4-position with a nitro group, and at the 2-position with a difluoromethyl group. The presence of these electronegative fluorine atoms and the nitro group contributes to its chemical reactivity and polarity, making it a potential candidate for various applications in pharmaceuticals and agrochemicals. The difluoromethyl group enhances its lipophilicity, while the nitro group can participate in electrophilic aromatic substitution reactions. Additionally, the compound's physical properties, such as boiling point, melting point, and solubility, are influenced by the arrangement and nature of its substituents. Safety data should be consulted for handling and storage, as compounds with nitro and fluorine groups can exhibit specific hazards.
Formula:C7H4F3NO2
InChI:InChI=1S/C7H4F3NO2/c8-6-2-1-4(11(12)13)3-5(6)7(9)10/h1-3,7H
InChI key:InChIKey=VXIMQWWMIPNFEO-UHFFFAOYSA-N
SMILES:C(F)(F)C1=CC(N(=O)=O)=CC=C1F
Synonyms:
  • 2-(Difluoromethyl)-1-fluoro-4-nitrobenzene
  • 3-Difluoromethyl-4-fluoro-1-nitrobenzene
  • Benzene, 2-(difluoromethyl)-1-fluoro-4-nitro-
  • α,α,2-Trifluoro-5-nitrotoluene
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