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CAS 175676-42-3

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Methanol, 1,1,1-trifluoro-, 1-(4-methylbenzenesulfonate)

Description:
Methanol, 1,1,1-trifluoro-, 1-(4-methylbenzenesulfonate), identified by CAS number 175676-42-3, is a chemical compound characterized by the presence of a trifluoromethyl group and a sulfonate moiety. This compound features a methanol backbone, which is modified by the introduction of three fluorine atoms at the first carbon position, enhancing its reactivity and polarity. The sulfonate group, derived from 4-methylbenzenesulfonic acid, contributes to the compound's solubility in polar solvents and its potential as a leaving group in nucleophilic substitution reactions. The trifluoromethyl group imparts unique electronic properties, making the compound useful in various chemical applications, including synthesis and as an intermediate in organic chemistry. Additionally, the presence of both the trifluoromethyl and sulfonate groups can influence the compound's physical properties, such as boiling point and stability. Overall, this compound is of interest in both industrial and research settings due to its distinctive structural features and reactivity.
Formula:C8H7F3O3S
InChI:InChI=1S/C8H7F3O3S/c1-6-2-4-7(5-3-6)15(12,13)14-8(9,10)11/h2-5H,1H3
InChI key:InChIKey=NHBKFPDJMAEDOS-UHFFFAOYSA-N
SMILES:S(OC(F)(F)F)(=O)(=O)C1=CC=C(C)C=C1
Synonyms:
  • Trifluoromethyl tosylate
  • Methanol, trifluoro-, 4-methylbenzenesulfonate
  • Methanol, 1,1,1-trifluoro-, 1-(4-methylbenzenesulfonate)
  • Trifluoromethyl 4-methylbenzenesulfonate
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