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CAS 2546-45-4

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1-(Methylthio)-4-(trifluoromethoxy)benzene

Description:
1-(Methylthio)-4-(trifluoromethoxy)benzene, with the CAS number 2546-45-4, is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with a methylthio group and a trifluoromethoxy group. The presence of the methylthio (-S-CH3) group contributes to its sulfur content, while the trifluoromethoxy (-O-CF3) group introduces significant electronegativity due to the three fluorine atoms, affecting the compound's reactivity and polarity. This compound is typically a colorless to pale yellow liquid or solid, depending on the temperature and purity. It is known for its potential applications in the synthesis of pharmaceuticals and agrochemicals, as well as in materials science. The trifluoromethoxy group can enhance the compound's lipophilicity and stability, making it useful in various chemical reactions. Safety data should be consulted for handling, as compounds with trifluoromethyl groups can exhibit unique toxicological properties. Overall, 1-(Methylthio)-4-(trifluoromethoxy)benzene is a notable compound in organic chemistry with specific functional characteristics.
Formula:C8H7F3OS
InChI:InChI=1S/C8H7F3OS/c1-13-7-4-2-6(3-5-7)12-8(9,10)11/h2-5H,1H3
InChI key:InChIKey=WGEFOOYHACYBNE-UHFFFAOYSA-N
SMILES:O(C(F)(F)F)C1=CC=C(SC)C=C1
Synonyms:
  • 1-(Methylthio)-4-(trifluoromethoxy)benzene
  • 4-(Methylsulfanyl)phenyl trifluoromethyl ether
  • 4-(Trifluoromethoxy)Phenyl Methyl Sulfide
  • Anisole, α,α,α-trifluoro-p-(methylthio)-
  • Benzene, 1-(methylthio)-4-(trifluoromethoxy)-
  • 1-(Methylsulfanyl)-4-(trifluoromethoxy)benzene
  • 1-Methylsulfanyl-4-(trifluoromethoxy)benzene
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