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CAS 1076199-20-6

:

1,1-Dimethylethyl 13-[3-(methoxycarbonyl)phenoxy]-5,8,11-trioxa-2-azatridecanoate

Description:
1,1-Dimethylethyl 13-[3-(methoxycarbonyl)phenoxy]-5,8,11-trioxa-2-azatridecanoate, identified by its CAS number 1076199-20-6, is a complex organic compound characterized by its unique structural features. It contains a branched alkyl group (1,1-dimethylethyl) that contributes to its hydrophobic properties, while the presence of a phenoxy group and a methoxycarbonyl moiety indicates potential for interactions with biological systems, possibly enhancing solubility in organic solvents. The compound also includes multiple ether linkages (trioxa) and an azetidine ring, which may influence its reactivity and stability. Its molecular structure suggests potential applications in pharmaceuticals or agrochemicals, where such functional groups can impart specific biological activities. Additionally, the presence of ester functionalities may indicate that it can undergo hydrolysis, making it relevant in studies of drug metabolism or environmental degradation. Overall, this compound exemplifies the complexity and diversity of organic molecules, with implications for both synthetic chemistry and practical applications.
Formula:C21H33NO8
InChI:InChI=1S/C21H33NO8/c1-21(2,3)30-20(24)22-8-9-26-10-11-27-12-13-28-14-15-29-18-7-5-6-17(16-18)19(23)25-4/h5-7,16H,8-15H2,1-4H3,(H,22,24)
InChI key:InChIKey=ZCKVHJVCFZYPLQ-UHFFFAOYSA-N
SMILES:O(CCOCCOCCOCCNC(OC(C)(C)C)=O)C1=CC(C(OC)=O)=CC=C1
Synonyms:
  • 5,8,11-Trioxa-2-azatridecanoic acid, 13-[3-(methoxycarbonyl)phenoxy]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 13-[3-(methoxycarbonyl)phenoxy]-5,8,11-trioxa-2-azatridecanoate
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