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CAS 500770-79-6

:

3-[(tert-butoxycarbonyl)amino]-3-[4-(trifluoromethyl)phenyl]propanoic acid

Description:
3-[(tert-butoxycarbonyl)amino]-3-[4-(trifluoromethyl)phenyl]propanoic acid, with CAS number 500770-79-6, is an organic compound characterized by its complex structure, which includes a propanoic acid backbone substituted with a tert-butoxycarbonyl (Boc) group and a 4-trifluoromethylphenyl moiety. The presence of the Boc group indicates that this compound is likely used in peptide synthesis as a protecting group for amines, enhancing its utility in organic synthesis. The trifluoromethyl group contributes to 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 is significant in the context of drug development and synthetic organic chemistry due to its functional versatility.
Formula:C15H18F3NO4
InChI:InChI=1/C15H18F3NO4/c1-14(2,3)23-13(22)19-11(8-12(20)21)9-4-6-10(7-5-9)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)c1ccc(cc1)C(F)(F)F)O
Synonyms:
  • (3S)-3-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-3-[4-(trifluoromethyl)phenyl]propanoic acid
  • Benzenepropanoic Acid, Beta-[[(1,1-Dimethylethoxy)Carbonyl]Amino]-4-(Trifluoromethyl)-
  • benzenepropanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(trifluoromethyl)-, (betaS)-
  • Boc-(R)-3-Amino-3-(4-trifluoromethylphenyl)-propionic acid
  • Boc-(S)-3-Amino-3-(4-trifluoromethylphenyl)-propionic acid
  • (R)-Boc-4-(Trifluoromethyl)-Beta-Phe-Oh
  • (S)-Boc-4-(Trifluoromethyl)-Beta-Phe-Oh
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