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CAS 1228559-39-4

:

(βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2,4-difluorobenzenepropanoic acid

Description:
The chemical substance known as (βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2,4-difluorobenzenepropanoic acid, with the CAS number 1228559-39-4, is characterized by its complex structure, which includes a propanoic acid moiety, a difluorobenzene ring, and a dimethylethoxycarbonyl group. This compound is likely to exhibit properties typical of amino acids and their derivatives, including potential solubility in polar solvents due to the presence of the carboxylic acid functional group. The difluorobenzene substituent may impart unique electronic and steric properties, influencing its reactivity and interactions in biological systems. The stereochemistry indicated by the (βR) designation suggests that the compound has a specific three-dimensional arrangement, which can significantly affect its biological activity and pharmacological profile. Overall, this compound may be of interest in medicinal chemistry and drug development, particularly in the design of molecules with targeted biological functions.
Formula:C14H17F2NO4
InChI:InChI=1S/C14H17F2NO4/c1-14(2,3)21-13(20)17-11(7-12(18)19)9-5-4-8(15)6-10(9)16/h4-6,11H,7H2,1-3H3,(H,17,20)(H,18,19)/t11-/m1/s1
InChI key:InChIKey=GCMABDJIXXRLPM-LLVKDONJSA-N
SMILES:[C@@H](NC(OC(C)(C)C)=O)(CC(O)=O)C1=C(F)C=C(F)C=C1
Synonyms:
  • Benzenepropanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-difluoro-, (βR)-
  • (βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2,4-difluorobenzenepropanoic acid
  • (3R)-3-[[(tert-Butoxy)carbonyl]amino]-3-(2,4-difluorophenyl)propanoic acid
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