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CAS 1187927-67-8

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1,1-Dimethylethyl 7-bromo-3,4-dihydro-4-oxo-1(2H)-quinolinecarboxylate

Description:
1,1-Dimethylethyl 7-bromo-3,4-dihydro-4-oxo-1(2H)-quinolinecarboxylate, identified by its CAS number 1187927-67-8, is a chemical compound that belongs to the class of quinoline derivatives. This substance features a quinoline core, which is characterized by a bicyclic structure containing a benzene ring fused to a pyridine ring. The presence of a bromo substituent indicates that it has halogen functionality, which can influence its reactivity and biological activity. The dimethyl group attached to the ethyl moiety suggests steric hindrance, potentially affecting the compound's interactions with biological targets. The carboxylate functional group indicates that it may exhibit acidic properties, which can be relevant in various chemical reactions. Additionally, the keto group (4-oxo) contributes to the compound's reactivity, possibly participating in nucleophilic addition or condensation reactions. Overall, this compound may have applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to its structural features that can interact with biological systems.
Formula:C14H16BrNO3
InChI:InChI=1S/C14H16BrNO3/c1-14(2,3)19-13(18)16-7-6-12(17)10-5-4-9(15)8-11(10)16/h4-5,8H,6-7H2,1-3H3
InChI key:InChIKey=KWUVVIPLFNGFMD-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C=2C(C(=O)CC1)=CC=C(Br)C2
Synonyms:
  • 1(2H)-Quinolinecarboxylic acid, 7-bromo-3,4-dihydro-4-oxo-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 7-bromo-3,4-dihydro-4-oxo-1(2H)-quinolinecarboxylate
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