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CAS 162358-08-9

:

1,3-Diethyl 2-(acetylamino)-2-[2-(4-octylphenyl)ethyl]propanedioate

Description:
1,3-Diethyl 2-(acetylamino)-2-[2-(4-octylphenyl)ethyl]propanedioate, with CAS number 162358-08-9, is an organic compound characterized by its complex structure, which includes multiple functional groups. It features diethyl ester groups, an acetylamino moiety, and a long alkyl chain derived from 4-octylphenyl, contributing to its hydrophobic characteristics. This compound is likely to exhibit moderate to low solubility in water due to the presence of the hydrophobic octyl group, while the ester and amide functionalities may impart some degree of polarity. The presence of the acetylamino group suggests potential for hydrogen bonding, which can influence its reactivity and interaction with biological systems. Additionally, the compound may exhibit interesting properties such as potential biological activity or utility in materials science, particularly in the development of surfactants or drug delivery systems. Its synthesis and applications would be of interest in organic chemistry and medicinal chemistry fields, where understanding the structure-activity relationship is crucial.
Formula:C25H39NO5
InChI:InChI=1S/C25H39NO5/c1-5-8-9-10-11-12-13-21-14-16-22(17-15-21)18-19-25(26-20(4)27,23(28)30-6-2)24(29)31-7-3/h14-17H,5-13,18-19H2,1-4H3,(H,26,27)
InChI key:InChIKey=RYOKCHIAMHPMLV-UHFFFAOYSA-N
SMILES:C(CCC1=CC=C(CCCCCCCC)C=C1)(C(OCC)=O)(C(OCC)=O)NC(C)=O
Synonyms:
  • (Acetylamino)[2-(4-octylphenyl)ethyl]propanedioic acid diethyl ester
  • 1,3-Diethyl 2-(acetylamino)-2-[2-(4-octylphenyl)ethyl]propanedioate
  • 2-Acetylamino-2-(2-(4-octylphenyl)ethyl)propanedioic acid diethyl ester
  • Diethyl 2-Acetamido-2-[2-(4-Octylphenyl)Ethyl]Propanedioate
  • Diethyl 2-[2-(4-n-octylphenyl)ethyl]-2-acetamidomalonate
  • Diethyl acetamido[2-(4-octylphenyl)ethyl]malonate
  • Propanedioic acid, (acetylamino)[2-(4-octylphenyl)ethyl]-, diethyl ester
  • Propanedioic acid, 2-(acetylamino)-2-[2-(4-octylphenyl)ethyl]-, 1,3-diethyl ester
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