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CAS 1099598-02-3

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1-Fluoro-3-methyl-5-(trifluoromethyl)benzene

Description:
1-Fluoro-3-methyl-5-(trifluoromethyl)benzene, with the CAS number 1099598-02-3, is an aromatic compound characterized by the presence of a fluorine atom, a methyl group, and a trifluoromethyl group attached to a benzene ring. This compound features a fluorine atom at the first position, a methyl group at the third position, and a trifluoromethyl group at the fifth position of the benzene ring, contributing to its unique chemical properties. The presence of multiple fluorine atoms enhances its lipophilicity and stability, making it potentially useful in various applications, including pharmaceuticals and agrochemicals. The trifluoromethyl group is known for imparting significant electronic effects, influencing the reactivity and polarity of the molecule. Additionally, the compound's structure suggests it may exhibit interesting physical properties, such as a relatively high boiling point and low solubility in water, typical of fluorinated compounds. Overall, 1-Fluoro-3-methyl-5-(trifluoromethyl)benzene is a notable example of a fluorinated aromatic compound with potential utility in diverse chemical applications.
Formula:C8H6F4
InChI:InChI=1S/C8H6F4/c1-5-2-6(8(10,11)12)4-7(9)3-5/h2-4H,1H3
InChI key:InChIKey=UWBNDZJSKMKSOD-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(C)=CC(F)=C1
Synonyms:
  • Benzene, 1-fluoro-3-methyl-5-(trifluoromethyl)-
  • 1-Fluoro-3-methyl-5-(trifluoromethyl)benzene
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