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CAS 1226776-88-0

:

4-Amino-2,6-difluoro-α-methylbenzeneacetic acid

Description:
4-Amino-2,6-difluoro-α-methylbenzeneacetic acid, identified by its CAS number 1226776-88-0, is a chemical compound characterized by the presence of an amino group, two fluorine atoms, and a methyl group attached to a benzene ring. This compound features a carboxylic acid functional group, which contributes to its acidic properties. The difluorination at the 2 and 6 positions of the benzene ring enhances its reactivity and may influence its biological activity. The amino group can participate in hydrogen bonding, making the compound potentially soluble in polar solvents. The presence of the α-methyl group can affect the steric hindrance and overall molecular conformation. Such structural features suggest that this compound may have applications in pharmaceuticals or agrochemicals, where fluorinated compounds are often valued for their unique properties. However, specific information regarding its toxicity, stability, and reactivity would require further investigation through experimental data and literature.
Formula:C9H9F2NO2
InChI:InChI=1S/C9H9F2NO2/c1-4(9(13)14)8-6(10)2-5(12)3-7(8)11/h2-4H,12H2,1H3,(H,13,14)
InChI key:InChIKey=XYFLWKUWRHZDGD-UHFFFAOYSA-N
SMILES:C(C(O)=O)(C)C1=C(F)C=C(N)C=C1F
Synonyms:
  • 4-Amino-2,6-difluoro-α-methylbenzeneacetic acid
  • Benzeneacetic acid, 4-amino-2,6-difluoro-α-methyl-
  • 2-(4-Amino-2,6-difluorophenyl)propanoic acid
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