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CAS 500770-78-5

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3-[(tert-butoxycarbonyl)amino]-3-[3-(trifluoromethyl)phenyl]propanoic acid

Description:
3-[(tert-butoxycarbonyl)amino]-3-[3-(trifluoromethyl)phenyl]propanoic acid, with CAS number 500770-78-5, is an organic compound characterized by its complex structure that includes a propanoic acid backbone, a tert-butoxycarbonyl (Boc) protecting group, and a trifluoromethyl-substituted phenyl group. The presence of the Boc group indicates that this compound is likely used in peptide synthesis or as an intermediate in organic synthesis, as it serves to protect amine functionalities during reactions. The trifluoromethyl group enhances the compound's lipophilicity and can influence its biological activity, making it of interest in medicinal chemistry. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its chemical properties, such as reactivity and stability, can be influenced by the functional groups present, particularly the acidic carboxylic acid and the electron-withdrawing trifluoromethyl group. Overall, this compound's unique characteristics make it valuable in various chemical and pharmaceutical applications.
Formula:C15H18F3NO4
InChI:InChI=1/C15H18F3NO4/c1-14(2,3)23-13(22)19-11(8-12(20)21)9-5-4-6-10(7-9)15(16,17)18/h4-7,11H,8H2,1-3H3,(H,19,22)(H,20,21)
SMILES:CC(C)(C)OC(=NC(CC(=O)O)c1cccc(c1)C(F)(F)F)O
Synonyms:
  • Boc-(R)-3-Amino-3-(3-trifluoromethylphenyl)-propionic acid
  • Boc-(S)-3-Amino-3-(3-trifluoromethylphenyl)-propionic acid
  • (R)-Boc-3-(Trifluoromethyl)-Beta-Phe-Oh
  • (S)-Boc-3-(Trifluoromethyl)-Beta-Phe-Oh
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