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CAS 1065094-16-7

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Ethyl 5-bromo-4-hydroxy-8-(trifluoromethyl)-3-quinolinecarboxylate

Description:
Ethyl 5-bromo-4-hydroxy-8-(trifluoromethyl)-3-quinolinecarboxylate is a synthetic organic compound characterized by its quinoline structure, which is a bicyclic aromatic compound containing a nitrogen atom. This substance features a bromine atom at the 5-position and a hydroxy group at the 4-position, contributing to its reactivity and potential biological activity. The presence of a trifluoromethyl group at the 8-position enhances its lipophilicity and may influence its pharmacokinetic properties. As an ester, the ethyl group attached to the carboxylate moiety suggests that it may undergo hydrolysis under certain conditions, releasing ethanol and forming the corresponding carboxylic acid. This compound may exhibit interesting properties in medicinal chemistry, particularly in the development of pharmaceuticals, due to its structural features that can interact with biological targets. Its CAS number, 1065094-16-7, allows for precise identification in chemical databases and literature. Overall, this compound's unique functional groups and structural characteristics make it a subject of interest in various chemical and biological research fields.
Formula:C13H9BrF3NO3
InChI:InChI=1S/C13H9BrF3NO3/c1-2-21-12(20)6-5-18-10-7(13(15,16)17)3-4-8(14)9(10)11(6)19/h3-5H,2H2,1H3,(H,18,19)
InChI key:InChIKey=KPVHPBNBNUKIEH-UHFFFAOYSA-N
SMILES:OC=1C2=C(C(C(F)(F)F)=CC=C2Br)N=CC1C(OCC)=O
Synonyms:
  • 3-Quinolinecarboxylic acid, 5-bromo-4-hydroxy-8-(trifluoromethyl)-, ethyl ester
  • Ethyl 5-bromo-4-hydroxy-8-(trifluoromethyl)-3-quinolinecarboxylate
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