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CAS 63516-10-9

:

8-Azoniabicyclo[3.2.1]octane, 8-(2-fluoroethyl)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8-methyl-, bromide (1:1), (3-endo,8-anti)-

Description:
8-Azoniabicyclo[3.2.1]octane, 8-(2-fluoroethyl)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8-methyl-, bromide (1:1), (3-endo,8-anti)- is a complex organic compound characterized by its bicyclic structure, which includes a quaternary ammonium group due to the presence of the azabicyclo framework. The compound features a fluoroethyl substituent, which can impart unique reactivity and properties, particularly in terms of its interaction with biological systems. The presence of a hydroxy group and a diphenylacetyl moiety suggests potential applications in medicinal chemistry, possibly as a drug or a pharmacological agent. The bromide ion serves as a counterion, stabilizing the quaternary ammonium structure. This compound may exhibit interesting solubility and reactivity profiles due to its polar and nonpolar components. Additionally, the specific stereochemistry indicated by the (3-endo, 8-anti) notation suggests that the compound may have distinct spatial arrangements that could influence its biological activity and interactions. Overall, this compound represents a fascinating area of study in organic and medicinal chemistry.
Formula:C24H29FNO3·Br
InChI:InChI=1/C24H29FNO3.BrH/c1-26(15-14-25)20-12-13-21(26)17-22(16-20)29-23(27)24(28,18-8-4-2-5-9-18)19-10-6-3-7-11-19;/h2-11,20-22,28H,12-17H2,1H3;1H/q+1;/p-1/t20-,21+,22+,26-;
InChI key:InChIKey=FNUZASGZEHGWQM-IWFNKLGFNA-M
SMILES:C(C(O[C@H]1C[C@@]2([N@+](CCF)(C)[C@](C1)(CC2)[H])[H])=O)(O)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
Synonyms:
  • 8-Azoniabicyclo[3.2.1]octane, 8-(2-fluoroethyl)-3-[(hydroxydiphenylacetyl)oxy]-8-methyl-, bromide, (endo,anti)-
  • 8-Azoniabicyclo[3.2.1]octane, 8-(2-fluoroethyl)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8-methyl-, bromide (1:1), (3-endo,8-anti)-
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