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CAS 898786-33-9

:

5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-nitrophenyl)-1-pentanone

Description:
5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-nitrophenyl)-1-pentanone, with the CAS number 898786-33-9, is an organic compound characterized by its complex structure that includes a dioxane ring and a nitrophenyl group. This compound features a pentanone backbone, which contributes to its ketone functionality, making it a potential candidate for various chemical reactions, including nucleophilic additions. The presence of the nitro group on the phenyl ring enhances its electrophilic properties, potentially increasing its reactivity in substitution reactions. The dioxane moiety adds to the compound's stability and solubility in organic solvents. This compound may exhibit interesting biological activities, making it of interest in medicinal chemistry and material science. Its unique structural features could also influence its physical properties, such as melting point, boiling point, and solubility, which are essential for applications in pharmaceuticals and chemical synthesis. Further studies would be necessary to fully elucidate its properties and potential applications.
Formula:C17H23NO5
InChI:InChI=1S/C17H23NO5/c1-17(2)11-22-16(23-12-17)9-4-3-8-15(19)13-6-5-7-14(10-13)18(20)21/h5-7,10,16H,3-4,8-9,11-12H2,1-2H3
InChI key:InChIKey=XYRDBDSYSRAOCM-UHFFFAOYSA-N
SMILES:C(CCCCC1OCC(C)(C)CO1)(=O)C2=CC(N(=O)=O)=CC=C2
Synonyms:
  • 5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(3-nitrophenyl)-1-pentanone
  • 1-Pentanone, 5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(3-nitrophenyl)-
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