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CAS 86702-58-1

:

(3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate

Description:
(3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, with CAS number 86702-58-1, is a chemical compound characterized by its bicyclic structure, which includes a nitrogen atom in the ring, contributing to its azabicyclic nature. This compound features a methoxy group and a hydroxy group on a phenyl ring, indicating potential for hydrogen bonding and increased solubility in polar solvents. The presence of the propenoate moiety suggests that it may participate in various chemical reactions, including Michael additions or polymerization processes. Its stereochemistry, particularly the endo configuration, may influence its biological activity and interaction with biological targets. This compound is of interest in medicinal chemistry and pharmacology, potentially serving as a lead compound for drug development due to its structural complexity and functional groups that may enhance biological activity. As with many organic compounds, its stability, reactivity, and solubility will depend on environmental conditions such as pH and temperature.
Formula:C18H23NO4
InChI:InChI=1/C18H23NO4/c1-19-13-5-6-14(19)11-15(10-13)23-18(21)8-4-12-3-7-16(20)17(9-12)22-2/h3-4,7-9,13-15,20H,5-6,10-11H2,1-2H3/b8-4+/t13-,14+,15+
InChI key:InChIKey=RSPBFOSKTPFBGJ-QFTXPMHWNA-N
SMILES:CN1[C@]2(C[C@H](OC(/C=C/C3=CC(OC)=C(O)C=C3)=O)C[C@@]1(CC2)[H])[H]
Synonyms:
  • 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [1α,3β(E),5α]-
  • (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate
  • 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (2E)-
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