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CAS 848611-90-5

:

3,5-Diethyl 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-3,5-piperidinedicarboxylate

Description:
3,5-Diethyl 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-3,5-piperidinedicarboxylate, with the CAS number 848611-90-5, is a complex organic compound characterized by its piperidine core structure, which is substituted with various functional groups. The presence of diethyl groups indicates that it has ethyl substituents at the 3 and 5 positions of the piperidine ring, enhancing its lipophilicity. The compound features a 4-chloro-3-nitrophenyl group, which introduces both electron-withdrawing and electron-donating characteristics, potentially influencing its reactivity and biological activity. Additionally, the presence of two trifluoromethyl groups contributes to its unique electronic properties and may enhance its stability and solubility in organic solvents. The two hydroxyl groups at the 2 and 6 positions suggest potential for hydrogen bonding, which could affect its interactions in biological systems. Overall, this compound's diverse functional groups suggest potential applications in pharmaceuticals or agrochemicals, although specific biological activities would require further investigation.
Formula:C19H19ClF6N2O8
InChI:InChI=1S/C19H19ClF6N2O8/c1-3-35-14(29)12-11(8-5-6-9(20)10(7-8)28(33)34)13(15(30)36-4-2)17(32,19(24,25)26)27-16(12,31)18(21,22)23/h5-7,11-13,27,31-32H,3-4H2,1-2H3
InChI key:InChIKey=RDMUJVWEBOAMQJ-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1C(C(C(OCC)=O)C(C(F)(F)F)(O)NC1(C(F)(F)F)O)C2=CC(N(=O)=O)=C(Cl)C=C2
Synonyms:
  • 3,5-Diethyl 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-3,5-piperidinedicarboxylate
  • 3,5-Piperidinedicarboxylic acid, 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, diethyl ester
  • 3,5-Piperidinedicarboxylic acid, 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, 3,5-diethyl ester
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