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CAS 944450-77-5

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(2,3,4,5,6-pentafluorophenyl) isoquinoline-4-carboxylate

Description:
(2,3,4,5,6-pentafluorophenyl) isoquinoline-4-carboxylate is a chemical compound characterized by its complex structure, which includes a pentafluorophenyl group and an isoquinoline moiety. The presence of five fluorine atoms on the phenyl ring significantly enhances the compound's electronegativity and lipophilicity, potentially influencing its reactivity and interaction with biological systems. The isoquinoline structure contributes to its aromaticity and may impart specific pharmacological properties. This compound is likely to exhibit high thermal stability due to the strong C-F bonds, making it suitable for various applications in organic synthesis and medicinal chemistry. Its carboxylate functional group can participate in hydrogen bonding and ionic interactions, which may be relevant in biological contexts. Overall, the unique combination of fluorinated and heterocyclic components suggests that this compound could be of interest in the development of pharmaceuticals or agrochemicals, although specific biological activity would require further investigation.
Formula:C16H6F5NO2
InChI:InChI=1/C16H6F5NO2/c17-10-11(18)13(20)15(14(21)12(10)19)24-16(23)9-6-22-5-7-3-1-2-4-8(7)9/h1-6H
SMILES:c1ccc2c(c1)cncc2C(=O)Oc1c(c(c(c(c1F)F)F)F)F
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