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CAS 886360-57-2

:

Methyl 4-[3-amino-3-oxo-1-[(2,2,2-trifluoroacetyl)amino]propyl]benzoate

Description:
Methyl 4-[3-amino-3-oxo-1-[(2,2,2-trifluoroacetyl)amino]propyl]benzoate, with the CAS number 886360-57-2, is a synthetic organic compound characterized by its complex structure, which includes a benzoate moiety and a trifluoroacetyl group. This compound features a methyl ester functional group, contributing to its solubility in organic solvents. The presence of amino and keto groups indicates potential for hydrogen bonding, which can influence its reactivity and interactions with biological systems. The trifluoroacetyl group enhances lipophilicity and may affect the compound's pharmacokinetic properties. Methyl 4-[3-amino-3-oxo-1-[(2,2,2-trifluoroacetyl)amino]propyl]benzoate may exhibit biological activity, making it of interest in medicinal chemistry and drug development. Its stability, solubility, and reactivity can be influenced by environmental factors such as pH and temperature. Overall, this compound represents a class of molecules that may have applications in pharmaceuticals or as intermediates in organic synthesis.
Formula:C13H13F3N2O4
InChI:InChI=1S/C13H13F3N2O4/c1-22-11(20)8-4-2-7(3-5-8)9(6-10(17)19)18-12(21)13(14,15)16/h2-5,9H,6H2,1H3,(H2,17,19)(H,18,21)
InChI key:InChIKey=SHFZCZSEFVTBMS-UHFFFAOYSA-N
SMILES:C(NC(C(F)(F)F)=O)(CC(N)=O)C1=CC=C(C(OC)=O)C=C1
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