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CAS 850568-47-7

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Boronic acid, B-(2-amino-4-cyanophenyl)-, hydrochloride (1:1)

Description:
Boronic acid, B-(2-amino-4-cyanophenyl)-, hydrochloride (1:1), with the CAS number 850568-47-7, is a chemical compound characterized by the presence of a boronic acid functional group attached to a phenyl ring that also contains an amino group and a cyano group. This compound typically appears as a white to off-white solid and is soluble in polar solvents such as water and alcohols, owing to its ionic nature when in hydrochloride form. The boronic acid moiety is known for its ability to form reversible covalent bonds with diols, making it useful in various applications, including organic synthesis and medicinal chemistry. The presence of the amino and cyano groups enhances its reactivity and potential biological activity, allowing for interactions with various biological targets. Additionally, the hydrochloride form indicates that the compound is protonated, which can influence its solubility and stability. Overall, this compound is of interest in research fields such as drug development and materials science due to its unique structural features and reactivity.
Formula:C7H7BN2O2·ClH
InChI:InChI=1S/C7H7BN2O2.ClH/c9-4-5-1-2-6(8(11)12)7(10)3-5;/h1-3,11-12H,10H2;1H
InChI key:InChIKey=XTCOKKVEUFHXBE-UHFFFAOYSA-N
SMILES:B(O)(O)C1=C(N)C=C(C#N)C=C1.Cl
Synonyms:
  • (2-Amino-4-cyanophenyl)boronic acid hydrochloride (1:1)
  • 2-Amino-4-cyanobenzeneboronic acid hydrochlorid
  • 2-Amino-4-cyanophenylboronic acid hydrochloride
  • Boronic acid, (2-amino-4-cyanophenyl)-, monohydrochloride
  • Boronic acid, B-(2-amino-4-cyanophenyl)-, hydrochloride (1:1)
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