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CAS 98968-67-3

:

Benzoic acid, 2-amino-4-chloro-3-methyl-, methyl ester

Description:
Benzoic acid, 2-amino-4-chloro-3-methyl-, methyl ester, with the CAS number 98968-67-3, is an organic compound characterized by its ester functional group, which is derived from benzoic acid. This compound features a benzoic acid backbone substituted with an amino group at the 2-position, a chlorine atom at the 4-position, and a methyl group at the 3-position. The presence of these substituents contributes to its unique chemical properties, including potential biological activity. It is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. The compound can participate in various chemical reactions, such as nucleophilic substitutions and esterifications, making it of interest in synthetic organic chemistry. Additionally, due to the presence of the amino and chloro groups, it may exhibit specific reactivity patterns and interactions in biological systems, which could be relevant for pharmaceutical applications. Safety data should be consulted for handling and usage, as with any chemical substance.
Formula:C9H10ClNO2
InChI:InChI=1S/C9H10ClNO2/c1-5-7(10)4-3-6(8(5)11)9(12)13-2/h3-4H,11H2,1-2H3
InChI key:InChIKey=SXQHVYMOFKXKPG-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(N)C(C)=C(Cl)C=C1
Synonyms:
  • Methyl 2-amino-4-chloro-3-methylbenzoate
  • Benzoic acid, 2-amino-4-chloro-3-methyl-, methyl ester
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