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CAS 120097-64-5

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1,3-Diethyl 2-(acetylamino)-2-(2,2,2-trifluoroethyl)propanedioate

Description:
1,3-Diethyl 2-(acetylamino)-2-(2,2,2-trifluoroethyl)propanedioate, with CAS number 120097-64-5, is a chemical compound characterized by its complex structure, which includes both ester and amide functional groups. This compound features a propanedioate backbone, which is substituted at the second carbon with an acetylamino group and a trifluoroethyl group. The presence of the trifluoroethyl moiety imparts unique properties, such as increased lipophilicity and potential biological activity. The diethyl ester groups contribute to its solubility in organic solvents and may influence its reactivity in various chemical reactions. Additionally, the compound may exhibit interesting pharmacological properties due to the combination of functional groups, making it a candidate for further research in medicinal chemistry. Its synthesis and applications could be relevant in fields such as drug development or agrochemicals, although specific applications would depend on further studies to elucidate its biological activity and efficacy.
Formula:C11H16F3NO5
InChI:InChI=1S/C11H16F3NO5/c1-4-19-8(17)10(15-7(3)16,6-11(12,13)14)9(18)20-5-2/h4-6H2,1-3H3,(H,15,16)
InChI key:InChIKey=DTCBHHXHXMSJQL-UHFFFAOYSA-N
SMILES:C(C(OCC)=O)(C(OCC)=O)(CC(F)(F)F)NC(C)=O
Synonyms:
  • Propanedioic acid, (acetylamino)(2,2,2-trifluoroethyl)-, diethyl ester
  • Propanedioic acid, 2-(acetylamino)-2-(2,2,2-trifluoroethyl)-, 1,3-diethyl ester
  • 1,3-Diethyl 2-acetamido-2-(2,2,2-trifluoroethyl)propanedioate
  • Diethyl 2-acetamido-2-(2,2,2-trifluoroethyl)propanedioate
  • 1,3-Diethyl 2-(acetylamino)-2-(2,2,2-trifluoroethyl)propanedioate
  • diethyl 2-acetaMido-2-(2,2,2-trifluoroethyl)Malonate
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