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CAS 1427398-87-5

:

Methyl 4-amino-2-fluoro-5-methylbenzoate

Description:
Methyl 4-amino-2-fluoro-5-methylbenzoate, identified by its CAS number 1427398-87-5, is an organic compound characterized by the presence of an amino group, a fluorine atom, and a methyl ester functional group. This compound features a benzoate structure, which consists of a benzene ring substituted with an amino group at the para position relative to the ester group, a fluorine atom at the ortho position, and a methyl group at the meta position. The presence of the fluorine atom can influence the compound's reactivity and polarity, potentially enhancing its biological activity. Methyl esters are generally known for their solubility in organic solvents and moderate stability under standard conditions. The compound may exhibit interesting properties in medicinal chemistry, particularly in the development of pharmaceuticals, due to the presence of both the amino and fluorine substituents, which can affect interactions with biological targets. As with many organic compounds, safety and handling precautions should be observed, particularly regarding potential toxicity and environmental impact.
Formula:C9H10FNO2
InChI:InChI=1S/C9H10FNO2/c1-5-3-6(9(12)13-2)7(10)4-8(5)11/h3-4H,11H2,1-2H3
InChI key:InChIKey=RPYSATQZZQGSQI-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(F)C=C(N)C(C)=C1
Synonyms:
  • Methyl 4-amino-2-fluoro-5-methylbenzoate
  • Benzoic acid, 4-amino-2-fluoro-5-methyl-, methyl ester
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