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CAS 159768-51-1

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Benzoic acid, 2-amino-4-fluoro-5-methoxy-, methyl ester

Description:
Benzoic acid, 2-amino-4-fluoro-5-methoxy-, methyl ester, with the CAS number 159768-51-1, is an organic compound characterized by its aromatic structure and functional groups. It features a benzoic acid core with an amino group (-NH2) and a methoxy group (-OCH3) attached to the aromatic ring, along with a fluorine atom at the 4-position. The methyl ester functionality indicates that the carboxylic acid group of benzoic acid is esterified with a methyl group. This compound is likely to exhibit properties typical of both benzoic acids and esters, such as moderate solubility in organic solvents and potential reactivity due to the presence of the amino and methoxy groups. Its fluorine substitution may enhance lipophilicity and influence biological activity. The presence of the amino group suggests potential for hydrogen bonding, which can affect its solubility and reactivity in various chemical environments. Overall, this compound may have applications in pharmaceuticals or as an intermediate in organic synthesis.
Formula:C9H10FNO3
InChI:InChI=1S/C9H10FNO3/c1-13-8-3-5(9(12)14-2)7(11)4-6(8)10/h3-4H,11H2,1-2H3
InChI key:InChIKey=YNDCEJXRQUITDF-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(N)C=C(F)C(OC)=C1
Synonyms:
  • Benzoic acid, 2-amino-4-fluoro-5-methoxy-, methyl ester
  • Methyl 4-fluoro-5-methoxyanthranilate
  • Methyl2-amino-4-fluoro-5-methoxybenzoate
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