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CAS 1398504-24-9

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2H-Pyran-4-carboxylic acid, 3-aminotetrahydro-, (3R,4R)-rel-, ethyl ester, 2,2,2-trifluoroacetate (1:1)

Description:
2H-Pyran-4-carboxylic acid, 3-aminotetrahydro-, (3R,4R)-rel-, ethyl ester, 2,2,2-trifluoroacetate (1:1) is a complex organic compound characterized by its pyran ring structure, which is a six-membered ring containing one oxygen atom. The presence of a carboxylic acid group and an ethyl ester indicates that it has both acidic and ester functionalities, contributing to its reactivity and potential applications in organic synthesis. The trifluoroacetate moiety enhances its stability and solubility in various solvents, making it useful in chemical reactions. The stereochemistry, denoted by (3R,4R)-rel-, suggests specific spatial arrangements of atoms, which can influence the compound's biological activity and interaction with other molecules. This compound may exhibit properties typical of pyran derivatives, such as potential antimicrobial or anti-inflammatory activities, although specific biological data would be necessary to confirm such effects. Overall, its unique structure and functional groups make it a candidate for further research in medicinal chemistry and synthetic applications.
Formula:C8H15NO3·C2HF3O2
InChI:InChI=1/C8H15NO3.C2HF3O2/c1-2-12-8(10)6-3-4-11-5-7(6)9;3-2(4,5)1(6)7/h6-7H,2-5,9H2,1H3;(H,6,7)/t6-,7+;/s2
InChI key:InChIKey=XNGOAWUKEJKCHO-ZOQHGOMKNA-N
SMILES:C(OCC)(=O)[C@H]1[C@@H](N)COCC1.C(C(O)=O)(F)(F)F
Synonyms:
  • 2H-Pyran-4-carboxylic acid, 3-aminotetrahydro-, (3R,4R)-rel-, ethyl ester, 2,2,2-trifluoroacetate (1:1)
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