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CAS 942474-80-8

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Ethyl 4-(4-hydroxy-1-piperidinyl)-3-nitrobenzoate

Description:
Ethyl 4-(4-hydroxy-1-piperidinyl)-3-nitrobenzoate, identified by its CAS number 942474-80-8, is a chemical compound that features a complex structure combining an ethyl ester with a nitro group and a piperidine moiety. This compound typically exhibits characteristics such as being a solid at room temperature, with potential solubility in organic solvents due to its ester functional group. The presence of the nitro group suggests it may have notable reactivity, particularly in electrophilic substitution reactions. The hydroxyl group on the piperidine ring can participate in hydrogen bonding, influencing its solubility and interaction with biological systems. Ethyl 4-(4-hydroxy-1-piperidinyl)-3-nitrobenzoate may be of interest in medicinal chemistry, potentially serving as a lead compound for the development of pharmaceuticals, given its structural features that could interact with biological targets. However, specific properties such as melting point, boiling point, and spectral data would require empirical measurement or literature reference for precise characterization.
Formula:C14H18N2O5
InChI:InChI=1S/C14H18N2O5/c1-2-21-14(18)10-3-4-12(13(9-10)16(19)20)15-7-5-11(17)6-8-15/h3-4,9,11,17H,2,5-8H2,1H3
InChI key:InChIKey=IJKYVSKTYUQAOF-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(C=CC(C(OCC)=O)=C1)N2CCC(O)CC2
Synonyms:
  • Ethyl 4-(4-hydroxy-1-piperidinyl)-3-nitrobenzoate
  • Benzoic acid, 4-(4-hydroxy-1-piperidinyl)-3-nitro-, ethyl ester
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