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CAS 952479-98-0

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Benzoic acid, 2-amino-5-fluoro-3-methyl-, methyl ester

Description:
Benzoic acid, 2-amino-5-fluoro-3-methyl-, methyl ester, identified by the CAS number 952479-98-0, is an organic compound characterized by its functional groups and structural features. It contains a benzoic acid moiety with an amino group and a fluorine atom substituted on the aromatic ring, along with a methyl ester group. This compound is likely to exhibit properties typical of both benzoic acids and esters, such as moderate solubility in organic solvents and potential acidity due to the carboxylic acid component. The presence of the amino group may impart basic characteristics, while the fluorine substitution can influence its reactivity and polarity. Additionally, the methyl ester group can enhance lipophilicity, affecting its biological activity and interactions. Such compounds are often studied for their potential applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. Overall, the specific characteristics, including melting point, boiling point, and reactivity, would require empirical data for precise determination.
Formula:C9H10FNO2
InChI:InChI=1S/C9H10FNO2/c1-5-3-6(10)4-7(8(5)11)9(12)13-2/h3-4H,11H2,1-2H3
InChI key:InChIKey=FZVXQHDTZQYNMO-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(N)C(C)=CC(F)=C1
Synonyms:
  • Benzoic acid, 2-amino-5-fluoro-3-methyl-, methyl ester
  • Methyl 2-amino-5-fluoro-3-methylbenzoate
  • Methyl2-amino-5-fluoro-3-methylbenzoate
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