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CAS 898781-29-8

:

Ethyl 2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-ε-oxobenzenehexanoate

Description:
Ethyl 2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-ε-oxobenzenehexanoate, identified by its CAS number 898781-29-8, is a complex organic compound characterized by its unique structural features. This substance contains a spirocyclic structure, which contributes to its potential biological activity and chemical reactivity. The presence of the dioxane and azaspiro moieties suggests that it may exhibit interesting properties, such as enhanced solubility or specific interactions with biological targets. The ethyl ester functional group indicates that it may participate in esterification reactions or hydrolysis, making it relevant in synthetic chemistry. Additionally, the compound's hexanoate chain may influence its lipophilicity and overall molecular interactions. While specific physical properties such as melting point, boiling point, and solubility are not detailed here, compounds of this nature often exhibit moderate to high stability under standard conditions, with potential applications in pharmaceuticals or materials science due to their structural complexity and functional diversity. Further studies would be necessary to elucidate its full range of characteristics and potential applications.
Formula:C22H31NO5
InChI:InChI=1S/C22H31NO5/c1-2-26-21(25)10-6-5-9-20(24)19-8-4-3-7-18(19)17-23-13-11-22(12-14-23)27-15-16-28-22/h3-4,7-8H,2,5-6,9-17H2,1H3
InChI key:InChIKey=SCXOYUXRBUANAC-UHFFFAOYSA-N
SMILES:C(N1CCC2(CC1)OCCO2)C3=C(C(CCCCC(OCC)=O)=O)C=CC=C3
Synonyms:
  • Ethyl 2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-ε-oxobenzenehexanoate
  • Ethyl 6-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl]-6-oxohexanoate
  • Benzenehexanoic acid, 2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-ε-oxo-, ethyl ester
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