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CAS 2102412-16-6

:

(αR)-4-Cyano-α-[[(1,1-dimethylethoxy)carbonyl]amino]benzeneacetic acid

Description:
(αR)-4-Cyano-α-[[(1,1-dimethylethoxy)carbonyl]amino]benzeneacetic acid is a chemical compound characterized by its complex structure, which includes a cyano group, an amino group, and a carboxylic acid functionality. The presence of the cyano group contributes to its potential reactivity and polarity, while the amino group can participate in hydrogen bonding, influencing its solubility and interaction with biological systems. The 1,1-dimethylethoxycarbonyl moiety serves as a protective group, enhancing the compound's stability and reactivity under specific conditions. This compound is likely to exhibit moderate to high solubility in polar solvents due to its functional groups. Its stereochemistry, indicated by the (αR) designation, suggests that it may exhibit specific biological activity or selectivity, which is important in pharmaceutical applications. Overall, this compound's unique combination of functional groups and stereochemistry makes it a subject of interest in medicinal chemistry and drug development.
Formula:C14H16N2O4
InChI:InChI=1S/C14H16N2O4/c1-14(2,3)20-13(19)16-11(12(17)18)10-6-4-9(8-15)5-7-10/h4-7,11H,1-3H3,(H,16,19)(H,17,18)/t11-/m1/s1
InChI key:InChIKey=LHQRGJCTILOATO-LLVKDONJSA-N
SMILES:[C@H](NC(OC(C)(C)C)=O)(C(O)=O)C1=CC=C(C#N)C=C1
Synonyms:
  • (αR)-4-Cyano-α-[[(1,1-dimethylethoxy)carbonyl]amino]benzeneacetic acid
  • Benzeneacetic acid, 4-cyano-α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (αR)-
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