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CAS 380886-37-3

:

1,1-Dimethylethyl (αR)-α-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]benzenepropanoate

Description:
1,1-Dimethylethyl (αR)-α-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]benzenepropanoate, identified by its CAS number 380886-37-3, is a chemical compound characterized by its complex structure, which includes a benzene ring, a propanoate group, and a dioxo-isoindole moiety. This compound is likely to exhibit properties typical of esters, such as being relatively non-polar and having moderate solubility in organic solvents. The presence of the dimethyl group suggests steric hindrance, which may influence its reactivity and interactions with biological systems. The specific stereochemistry indicated by the (αR) designation implies that the compound may exhibit chiral properties, potentially affecting its biological activity and pharmacokinetics. Additionally, the dioxo-isoindole structure may contribute to unique electronic properties, making it of interest in various fields, including medicinal chemistry and materials science. Overall, the compound's characteristics, including its solubility, reactivity, and biological activity, would be influenced by its intricate molecular architecture.
Formula:C21H21NO5
InChI:InChI=1S/C21H21NO5/c1-21(2,3)26-20(25)17(13-14-9-5-4-6-10-14)27-22-18(23)15-11-7-8-12-16(15)19(22)24/h4-12,17H,13H2,1-3H3/t17-/m1/s1
InChI key:InChIKey=SPIKPMRNIFSZOL-QGZVFWFLSA-N
SMILES:O([C@H](CC1=CC=CC=C1)C(OC(C)(C)C)=O)N2C(=O)C=3C(C2=O)=CC=CC3
Synonyms:
  • Benzenepropanoic acid, α-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]-, 1,1-dimethylethyl ester, (αR)-
  • (R)-tert-Butyl 2-((1,3-dioxoisoindolin-2-yl)oxy)-3-phenylpropanoate
  • 1,1-Dimethylethyl (αR)-α-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]benzenepropanoate
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