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CAS 893566-74-0

:

tert-butyl 6-bromo-3,4-dihydro-1H-isoquinoline-2-carboxylate

Description:
Tert-butyl 6-bromo-3,4-dihydro-1H-isoquinoline-2-carboxylate is a chemical compound characterized by its isoquinoline structure, which is a bicyclic compound containing a benzene ring fused to a pyridine ring. The presence of a tert-butyl group enhances its lipophilicity, making it more soluble in organic solvents. The bromine atom at the 6-position introduces a halogen functionality, which can be useful for further chemical modifications or reactions, such as nucleophilic substitutions. The carboxylate group at the 2-position contributes to the compound's acidity and reactivity, allowing it to participate in various chemical reactions, including esterification and amidation. This compound may exhibit biological activity, making it of interest in medicinal chemistry and drug development. Its unique structural features and functional groups suggest potential applications in synthetic organic chemistry and pharmacology. As with many organic compounds, proper handling and safety precautions are essential due to potential toxicity or reactivity.
Formula:C14H18BrNO2
InChI:InChI=1S/C14H18BrNO2/c1-14(2,3)18-13(17)16-7-6-10-8-12(15)5-4-11(10)9-16/h4-5,8H,6-7,9H2,1-3H3
InChI key:InChIKey=SZIPGDGOBMFCEH-UHFFFAOYSA-N
SMILES:CC(C)(C)OC(=O)N1CCc2cc(ccc2C1)Br
Synonyms:
  • 1,1-Dimethylethyl 6-bromo-3,4-dihydro-2(1H)-isoquinolinecarboxylate
  • 2(1H)-Isoquinolinecarboxylic acid, 6-bromo-3,4-dihydro-, 1,1-dimethylethyl ester
  • 6-Bromo-2-tert-butoxycarbonyl-1,2,3,4-tetrahydroisoquinoline
  • 6-bromo-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester
  • tert-butyl 6-bromo-3,4-dihydroisoquinoline-2(1H)-carboxylate
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