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CAS 913835-78-6

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Boronic acid, B-[3-nitro-5-[(phenylmethyl)amino]phenyl]-, hydrochloride (1:1)

Description:
Boronic acid, specifically B-[3-nitro-5-[(phenylmethyl)amino]phenyl]-, hydrochloride (1:1), is a compound characterized by the presence of a boron atom bonded to a phenyl ring and an amino group, along with a nitro substituent. This compound typically exhibits properties associated with boronic acids, such as the ability to form reversible covalent bonds with diols, making it useful in various applications, including organic synthesis and medicinal chemistry. The hydrochloride form indicates that the compound is a salt, which can enhance its solubility in water and stability. The presence of the nitro group suggests potential for reactivity and participation in electrophilic aromatic substitution reactions. Additionally, the phenylmethylamino group may impart specific biological activity, making this compound of interest in pharmaceutical research. Overall, this boronic acid derivative combines unique structural features that contribute to its chemical behavior and potential applications in diverse fields.
Formula:C13H13BN2O4·ClH
InChI:InChI=1S/C13H13BN2O4.ClH/c17-14(18)11-6-12(8-13(7-11)16(19)20)15-9-10-4-2-1-3-5-10;/h1-8,15,17-18H,9H2;1H
InChI key:InChIKey=YSXGPPOSKCOXDK-UHFFFAOYSA-N
SMILES:N(CC1=CC=CC=C1)C2=CC(B(O)O)=CC(N(=O)=O)=C2.Cl
Synonyms:
  • Boronic acid, [3-nitro-5-[(phenylmethyl)amino]phenyl]-, monohydrochloride
  • Boronic acid, B-[3-nitro-5-[(phenylmethyl)amino]phenyl]-, hydrochloride (1:1)
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