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CAS 886498-39-1

:

2,4,5-Trifluorobenzenemethanethiol

Description:
2,4,5-Trifluorobenzenemethanethiol, identified by its CAS number 886498-39-1, is an organofluorine compound characterized by the presence of three fluorine atoms attached to a benzene ring, along with a thiol (-SH) functional group linked to a methylene (-CH2-) bridge. This compound exhibits unique properties due to the electronegative fluorine atoms, which can influence its reactivity, polarity, and overall chemical behavior. The trifluoromethyl substituents typically enhance the compound's stability and lipophilicity, making it of interest in various chemical applications, including pharmaceuticals and agrochemicals. The thiol group contributes to its potential as a nucleophile in chemical reactions, allowing for the formation of disulfides or other sulfur-containing compounds. Additionally, the presence of fluorine can impart distinctive spectroscopic characteristics, making it detectable by techniques such as NMR and mass spectrometry. Overall, 2,4,5-Trifluorobenzenemethanethiol is a valuable compound in synthetic chemistry and materials science, with potential applications in developing new functional materials.
Formula:C7H5F3S
InChI:InChI=1S/C7H5F3S/c8-5-2-7(10)6(9)1-4(5)3-11/h1-2,11H,3H2
InChI key:InChIKey=QFBHRKDQSUTVIR-UHFFFAOYSA-N
SMILES:C(S)C1=C(F)C=C(F)C(F)=C1
Synonyms:
  • 2,4,5-Trifluorobenzenemethanethiol
  • 2,4,5-Trifluorobenzylmercaptan
  • Benzenemethanethiol, 2,4,5-trifluoro-
  • (2,4,5-Trifluorophenyl)methanethiol
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