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CAS 630121-86-7

:

tert-Butyl 3-[[(trifluoromethyl)sulfonyl]oxy]-2,5-dihydro-1H-pyrrole-1-carboxylate

Description:
Tert-Butyl 3-[[(trifluoromethyl)sulfonyl]oxy]-2,5-dihydro-1H-pyrrole-1-carboxylate is a chemical compound characterized by its unique structural features, including a pyrrole ring and a trifluoromethylsulfonyl group. This compound typically exhibits properties such as high stability due to the presence of the tert-butyl group, which enhances its lipophilicity and solubility in organic solvents. The trifluoromethylsulfonyl moiety contributes to its reactivity, making it a useful intermediate in various synthetic applications, particularly in medicinal chemistry and agrochemicals. Additionally, the presence of the carboxylate group suggests potential for hydrogen bonding and interactions with biological targets. The compound's molecular structure allows for diverse functionalization, making it valuable in the development of novel pharmaceuticals. Its CAS number, 630121-86-7, facilitates its identification in chemical databases, aiding researchers in sourcing and studying its properties and applications. Overall, this compound exemplifies the intersection of structural complexity and functional utility in organic chemistry.
Formula:C10H14F3NO5S
InChI:InChI=1S/C10H14F3NO5S/c1-9(2,3)18-8(15)14-5-4-7(6-14)19-20(16,17)10(11,12)13/h4H,5-6H2,1-3H3
InChI key:InChIKey=FXWRRWKJFCPRBG-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CC(OS(C(F)(F)F)(=O)=O)=CC1
Synonyms:
  • tert-Butyl 3-(trifluoromethanesulfonyloxy)-2,5-dihydropyrrole-1-carboxylate
  • 3-[[(Trifluoromethyl)sulfonyl]oxy]-2,5-dihydro-1H-pyrrole-1-carboxylic acid tert-butyl ester
  • tert-Butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate
  • 1H-Pyrrole-1-carboxylic acid, 2,5-dihydro-3-[[(trifluoromethyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester
  • tert-Butyl 3-[[(trifluoromethyl)sulfonyl]oxy]-2,5-dihydro-1H-pyrrole-1-carboxylate
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