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CAS 845616-83-3

:

5-(Methylsulfonyl)-2-[(1R)-2,2,2-trifluoro-1-methylethoxy]benzoic acid

Description:
5-(Methylsulfonyl)-2-[(1R)-2,2,2-trifluoro-1-methylethoxy]benzoic acid, with the CAS number 845616-83-3, is a chemical compound characterized by its complex structure, which includes a benzoic acid moiety substituted with a methylsulfonyl group and a trifluoroalkyl ether. This compound exhibits properties typical of benzoic acids, such as acidity due to the carboxylic acid functional group, and it may also demonstrate unique solubility characteristics owing to the presence of the trifluoroethyl group, which can enhance lipophilicity. The methylsulfonyl group contributes to its potential as a polar functional group, influencing its reactivity and interaction with biological systems. The trifluoromethyl group is known for imparting stability and altering the electronic properties of the molecule, which can affect its biological activity and pharmacokinetics. Overall, this compound may be of interest in medicinal chemistry and pharmaceutical applications, particularly in the development of novel therapeutic agents.
Formula:C11H11F3O5S
InChI:InChI=1S/C11H11F3O5S/c1-6(11(12,13)14)19-9-4-3-7(20(2,17)18)5-8(9)10(15)16/h3-6H,1-2H3,(H,15,16)/t6-/m1/s1
InChI key:InChIKey=KAFINIUNMPCGFL-ZCFIWIBFSA-N
SMILES:O([C@@H](C(F)(F)F)C)C1=C(C(O)=O)C=C(S(C)(=O)=O)C=C1
Synonyms:
  • 5-(Methylsulfonyl)-2-[(1R)-2,2,2-trifluoro-1-methylethoxy]benzoic acid
  • Benzoic acid, 5-(methylsulfonyl)-2-[(1R)-2,2,2-trifluoro-1-methylethoxy]-
  • 5-Methylsulfonyl-2-[((R)-2,2,2-trifluoro-1-methylethyl)oxy]benzoic acid
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