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CAS 114872-54-7

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1,3-Diethyl 2-(acetylamino)-2-[(3-chlorophenyl)methyl]propanedioate

Description:
1,3-Diethyl 2-(acetylamino)-2-[(3-chlorophenyl)methyl]propanedioate, with the CAS number 114872-54-7, is a chemical compound characterized by its complex structure, which includes an acetylamino group and a chlorophenyl moiety. This substance typically exhibits properties associated with esters and amides, such as moderate solubility in organic solvents and potential reactivity due to the presence of functional groups. The presence of the diethyl ester component suggests it may have a relatively low boiling point and could be sensitive to hydrolysis in the presence of water or moisture. Additionally, the chlorophenyl group may impart specific electronic properties, influencing its reactivity and interactions with biological systems. This compound may be of interest in medicinal chemistry or as an intermediate in organic synthesis, although specific applications would depend on further research into its biological activity and stability. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C16H20ClNO5
InChI:InChI=1S/C16H20ClNO5/c1-4-22-14(20)16(18-11(3)19,15(21)23-5-2)10-12-7-6-8-13(17)9-12/h6-9H,4-5,10H2,1-3H3,(H,18,19)
InChI key:InChIKey=QMVKBWYLKUGYDG-UHFFFAOYSA-N
SMILES:C(CC1=CC(Cl)=CC=C1)(C(OCC)=O)(C(OCC)=O)NC(C)=O
Synonyms:
  • Propanedioic acid, 2-(acetylamino)-2-[(3-chlorophenyl)methyl]-, 1,3-diethyl ester
  • Propanedioic acid, (acetylamino)[(3-chlorophenyl)methyl]-, diethyl ester
  • 1,3-Diethyl 2-(acetylamino)-2-[(3-chlorophenyl)methyl]propanedioate
  • 2-Acetylamino-2-(3-chloro-benzyl)-malonic acid diethyl ester
  • Diethyl 2-acetamido-2-(3-chlorobenzyl)malonate
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