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CAS 874784-13-1

:

6-[(2,2-Dimethyl-1-oxopropyl)amino]-2,3-difluorobenzoic acid

Description:
6-[(2,2-Dimethyl-1-oxopropyl)amino]-2,3-difluorobenzoic acid, with the CAS number 874784-13-1, is a synthetic organic compound characterized by its unique structure, which includes a benzoic acid moiety substituted with two fluorine atoms and an amino group linked to a dimethyl-1-oxopropyl chain. This compound typically exhibits properties associated with both aromatic and aliphatic systems, including potential hydrophobic interactions due to the fluorine substitutions and the bulky dimethyl group. The presence of the carboxylic acid functional group suggests it can participate in acid-base reactions, while the amino group may allow for hydrogen bonding and interactions with biological targets. Its fluorinated nature may enhance lipophilicity and metabolic stability, making it of interest in pharmaceutical applications. Additionally, the compound's specific stereochemistry and functional groups can influence its reactivity, solubility, and biological activity, making it a candidate for further research in medicinal chemistry and drug development.
Formula:C12H13F2NO3
InChI:InChI=1S/C12H13F2NO3/c1-12(2,3)11(18)15-7-5-4-6(13)9(14)8(7)10(16)17/h4-5H,1-3H3,(H,15,18)(H,16,17)
InChI key:InChIKey=KNCVGCGLFIHUST-UHFFFAOYSA-N
SMILES:N(C(C(C)(C)C)=O)C1=C(C(O)=O)C(F)=C(F)C=C1
Synonyms:
  • Benzoic acid, 6-[(2,2-dimethyl-1-oxopropyl)amino]-2,3-difluoro-
  • 6-[(2,2-Dimethyl-1-oxopropyl)amino]-2,3-difluorobenzoic acid
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