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CAS 954225-38-8

:

β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-(trifluoromethyl)benzenepropanoic acid

Description:
β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-(trifluoromethyl)benzenepropanoic acid, with the CAS number 954225-38-8, is a synthetic organic compound characterized by its complex structure, which includes a benzene ring substituted with a trifluoromethyl group and an amino acid moiety. This compound features a dimethylethoxycarbonyl group, which contributes to its stability and solubility in organic solvents. The presence of the trifluoromethyl group enhances its lipophilicity and may influence its biological activity, making it of interest in pharmaceutical research. The compound is likely to exhibit acidic properties due to the carboxylic acid functional group, which can participate in hydrogen bonding and ionic interactions. Its unique structural features may also allow for specific interactions with biological targets, potentially leading to applications in drug development. Overall, this compound represents a class of molecules that combine aromatic and aliphatic characteristics, making it a subject of interest in medicinal chemistry and material science.
Formula:C15H18F3NO4
InChI:InChI=1S/C15H18F3NO4/c1-14(2,3)23-13(22)19-11(8-12(20)21)9-6-4-5-7-10(9)15(16,17)18/h4-7,11H,8H2,1-3H3,(H,19,22)(H,20,21)
InChI key:InChIKey=DYZRXQICSTZZKP-UHFFFAOYSA-N
SMILES:C(NC(OC(C)(C)C)=O)(CC(O)=O)C1=C(C(F)(F)F)C=CC=C1
Synonyms:
  • Benzenepropanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-2-(trifluoromethyl)-
  • β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-(trifluoromethyl)benzenepropanoic acid
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