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CAS 380430-55-7

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Benzoic acid, 3-amino-4-borono-, 1-methyl ester, hydrochloride (1:1)

Description:
Benzoic acid, 3-amino-4-borono-, 1-methyl ester, hydrochloride (1:1) is a chemical compound characterized by its structural features that include a benzoic acid moiety, an amino group, and a boron-containing functional group. The presence of the methyl ester indicates that the carboxylic acid group of benzoic acid is esterified, which can influence its solubility and reactivity. The hydrochloride form suggests that the compound is a salt, enhancing its stability and solubility in aqueous solutions. This compound may exhibit properties typical of both organic acids and amines, such as potential acidity and basicity, depending on the pH of the environment. Additionally, the boron atom can impart unique reactivity, making it useful in various chemical applications, including medicinal chemistry and materials science. The specific interactions and biological activities of this compound would depend on its molecular structure and the functional groups present, which can influence its behavior in biological systems and chemical reactions.
Formula:C8H10BNO4·ClH
InChI:InChI=1S/C8H10BNO4.ClH/c1-14-8(11)5-2-3-6(9(12)13)7(10)4-5;/h2-4,12-13H,10H2,1H3;1H
InChI key:InChIKey=IDUSDMZTKZZVAW-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(N)=C(B(O)O)C=C1.Cl
Synonyms:
  • 2-(Dihydroxyboranyl)-5-(Methoxycarbonyl)Anilinium Chloride
  • 2-Amino-4-(Methoxycarbonyl)Phenylboronic Acid Hydrochloride
  • 2-Amino-4-(carbomethoxy)phenylboronic acid hydrochloride
  • 2-Amino-4-(methoxycarbonyl)benzeneboronic acid hydrochloride
  • Benzoic acid, 3-amino-4-borono-, 1-methyl ester, hydrochloride
  • Benzoic acid, 3-amino-4-borono-, 1-methyl ester, hydrochloride (1:1)
  • [2-Amino-4-(methoxycarbonyl)phenyl]boronic acid hydrochloride
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