CAS 232941-14-9: Benzoic acid, 4-(acetylamino)-3-bromo-5-chloro-2-hydroxy-, methyl ester

Description: Benzoic acid, 4-(acetylamino)-3-bromo-5-chloro-2-hydroxy-, methyl ester, identified by CAS number 232941-14-9, is a chemical compound that belongs to the class of benzoic acid derivatives. This substance features a benzoic acid core with several functional groups, including an acetylamino group, a bromo substituent, a chloro substituent, and a hydroxy group, which contribute to its reactivity and potential applications. The presence of the methyl ester indicates that it can undergo hydrolysis to release methanol and form the corresponding benzoic acid. This compound may exhibit biological activity due to its structural features, making it of interest in pharmaceutical research. Its solubility characteristics are influenced by the polar functional groups, which may enhance its interaction with biological systems. Additionally, the halogen substituents (bromo and chloro) can affect the compound's stability and reactivity, potentially making it useful in various synthetic applications or as an intermediate in organic synthesis.

Formula: C₁₀H₉BrClNO₄

InChI: InChI=1S/C10H9BrClNO4/c1-4(14)13-8-6(12)3-5(10(16)17-2)9(15)7(8)11/h3,15H,1-2H3,(H,13,14)

InChI key: InChIKey=JVHHLYLHOXWORE-UHFFFAOYSA-N

SMILES: O=C(OC)C1=CC(Cl)=C(NC(=O)C)C(Br)=C1O

Synonyms:

• Benzoic acid, 4-(acetylamino)-3-bromo-5-chloro-2-hydroxy-, methyl ester
• Methyl 4-(acetylaMino)-3-broMo-5-chloro-2-hydroxybenzoate
• Methyl 4-acetamido-3-bromo-5-chloro-2-hydroxybenzoate
• Methyl 4-(acetylamino)-3-bromo-5-chloro-2-hydroxybenzoate

Prucalopride Impurity 38

CAS: 232941-14-9

• Formula: C₁₀H₉BrClNO₄
• Color and Shape: White To Off-White Solid
• Molecular weight: 322.54