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CAS 129822-47-5

:

tert-butyl 5-fluoroindole-1-carboxylate

Description:
Tert-butyl 5-fluoroindole-1-carboxylate is a chemical compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. The presence of a tert-butyl group enhances its lipophilicity, making it more soluble in organic solvents. The 5-fluoro substitution introduces a fluorine atom at the fifth position of the indole ring, which can influence the compound's electronic properties and reactivity. The carboxylate functional group, derived from the carboxylic acid, contributes to the compound's acidity and potential for forming salts or participating in esterification reactions. This compound is often utilized in organic synthesis and medicinal chemistry, particularly in the development of pharmaceuticals, due to its ability to serve as a building block for more complex molecules. Its unique structural features may also impart specific biological activities, making it of interest in drug discovery and development. As with many chemical substances, proper handling and safety measures should be observed due to potential hazards associated with its use.
Formula:C13H14FNO2
InChI:InChI=1/C13H14FNO2/c1-13(2,3)17-12(16)15-7-6-9-8-10(14)4-5-11(9)15/h4-8H,1-3H3
InChI key:InChIKey=PCZRVRIBJPHEBB-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C=2C(C=C1)=CC(F)=CC2
Synonyms:
  • 1,1-Dimethylethyl 5-fluoro-1H-indole-1-carboxylate
  • 1-(tert-Butoxycarbonyl)-5-fluoroindole
  • 1-BOC-5-fluoro-1H-indole
  • 1H-Indole-1-carboxylic acid, 5-fluoro-, 1,1-dimethylethyl ester
  • tert-Butyl 5-fluoro-1H-indol-1-carboxylate
  • tert-Butyl 5-fluoro-1H-indole-1-carboxylate
  • 5-fluoro-1-indolecarboxylic acid tert-butyl ester
  • 5-Fluoro-N-(BOC)indole
  • 1-Boc-5-fluoroindole
  • N-Boc-5-fluoroindole
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