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CAS 848678-60-4

:

Benzoic acid, 3-amino-6-fluoro-2-methyl-, methyl ester

Description:
Benzoic acid, 3-amino-6-fluoro-2-methyl-, methyl ester, identified by the CAS number 848678-60-4, is an organic compound characterized by its benzoic acid structure modified with an amino group, a fluorine atom, and a methyl ester functional group. This compound typically exhibits properties associated with both aromatic and aliphatic systems, including potential solubility in organic solvents and moderate polarity due to the presence of the ester and amino functionalities. The amino group can participate in hydrogen bonding, influencing its reactivity and interaction with biological systems. The fluorine atom may impart unique electronic properties, enhancing the compound's stability and potentially affecting its biological activity. As a methyl ester, it is likely to be more lipophilic than its corresponding acid, which can influence its absorption and distribution in biological contexts. Overall, this compound may have applications in pharmaceuticals or agrochemicals, where modifications to benzoic acid derivatives are often explored for enhanced efficacy or specificity.
Formula:C9H10FNO2
InChI:InChI=1S/C9H10FNO2/c1-5-7(11)4-3-6(10)8(5)9(12)13-2/h3-4H,11H2,1-2H3
InChI key:InChIKey=GCLVXDCQEQNQOG-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(C)C(N)=CC=C1F
Synonyms:
  • Methyl 3-amino-6-fluoro-2-methylbenzoate
  • Benzoic acid, 3-amino-6-fluoro-2-methyl-, methyl ester
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