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CAS 328270-33-3

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2-Chloro-N-(4-chlorobenzoyl)-3,3,3-trifluoroalanine ethyl ester

Description:
2-Chloro-N-(4-chlorobenzoyl)-3,3,3-trifluoroalanine ethyl ester is a synthetic organic compound characterized by its complex structure, which includes a chloro group, a trifluoroalanine moiety, and an ethyl ester functional group. This compound typically exhibits properties associated with both halogenated and amino acid derivatives, such as increased lipophilicity due to the presence of fluorine and chlorine atoms. The trifluoromethyl group contributes to its unique reactivity and potential biological activity, making it of interest in pharmaceutical research. The ethyl ester functionality suggests that it may undergo hydrolysis to release the corresponding acid, which could be relevant in biological systems. Additionally, the presence of the chlorobenzoyl group may enhance its ability to interact with biological targets, potentially influencing its pharmacokinetic properties. Overall, this compound's characteristics make it a candidate for further investigation in medicinal chemistry and related fields.
Formula:C12H10Cl2F3NO3
InChI:InChI=1S/C12H10Cl2F3NO3/c1-2-21-10(20)11(14,12(15,16)17)18-9(19)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H,18,19)
InChI key:InChIKey=DCJQDQRFBLRLAR-UHFFFAOYSA-N
SMILES:C(NC(=O)C1=CC=C(Cl)C=C1)(C(OCC)=O)(C(F)(F)F)Cl
Synonyms:
  • Alanine, 2-chloro-N-(4-chlorobenzoyl)-3,3,3-trifluoro-, ethyl ester
  • 2-Chloro-N-(4-chlorobenzoyl)-3,3,3-trifluoroalanine ethyl ester
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