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CAS 270065-76-4

:

(βS)-β-Amino-3-(trifluoromethyl)benzenebutanoic acid

Description:
(βS)-β-Amino-3-(trifluoromethyl)benzenebutanoic acid, identified by its CAS number 270065-76-4, is an organic compound characterized by the presence of both an amino group and a carboxylic acid functional group, making it an amino acid derivative. The structure features a trifluoromethyl group, which significantly influences its chemical properties, including increased lipophilicity and potential biological activity. The β-amino configuration indicates that the amino group is positioned on the β-carbon relative to the carboxylic acid, which can affect its stereochemistry and interactions in biological systems. This compound may exhibit unique pharmacological properties due to the trifluoromethyl group, which is known to enhance metabolic stability and alter the binding affinity to biological targets. Its potential applications could span various fields, including medicinal chemistry and drug design, particularly in the development of novel therapeutics. As with many fluorinated compounds, it is essential to consider its environmental impact and bioaccumulation potential during synthesis and application.
Formula:C11H12F3NO2
InChI:InChI=1S/C11H12F3NO2/c12-11(13,14)8-3-1-2-7(4-8)5-9(15)6-10(16)17/h1-4,9H,5-6,15H2,(H,16,17)/t9-/m0/s1
InChI key:InChIKey=UUVNRBNPVFBPTH-VIFPVBQESA-N
SMILES:C([C@@H](CC(O)=O)N)C1=CC(C(F)(F)F)=CC=C1
Synonyms:
  • (3S)-3-amino-4-[3-(trifluoromethyl)phenyl]butanoic acid hydrochloride
  • (S)-3-Amino-4-(3-Trifluoromethylphenyl)Butanoic Acid Hydrochloride
  • (S)-3-Amino-4-(3-trifluoromethylphenyl)butanoic acid
  • (βS)-β-Amino-3-(trifluoromethyl)benzenebutanoic acid
  • Benzenebutanoic acid, β-amino-3-(trifluoromethyl)-, (βS)-
  • H-β-HoPhe(3-CF3)-OH.HCl
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