CAS 957120-51-3: Boronic acid,B-[3-chloro-5-[(methylamino)carbonyl]phenyl]-

Description: Boronic acid, specifically B-[3-chloro-5-[(methylamino)carbonyl]phenyl]- (CAS 957120-51-3), is an organic compound characterized by the presence of a boron atom bonded to a phenyl group that contains a chloro substituent and a methylamino carbonyl group. This compound typically exhibits properties associated with boronic acids, such as the ability to form reversible complexes with diols, making it useful in various applications, including organic synthesis and medicinal chemistry. The presence of the chloro group can influence its reactivity and solubility, while the methylamino carbonyl moiety may enhance its biological activity. Boronic acids are known for their role in Suzuki coupling reactions, which are pivotal in forming carbon-carbon bonds in organic synthesis. Additionally, the compound may exhibit specific interactions with biological targets, making it of interest in drug development. Overall, its unique structural features contribute to its potential utility in both synthetic and pharmaceutical chemistry.

Formula: C₈H₉BClNO₃

InChI: InChI=1S/C8H9BClNO3/c1-11-8(12)5-2-6(9(13)14)4-7(10)3-5/h2-4,13-14H,1H3,(H,11,12)

InChI key: InChIKey=XZSSZKPRYZCKDO-UHFFFAOYSA-N

SMILES: O=C(NC)C=1C=C(Cl)C=C(C1)B(O)O

Synonyms:

• (3-Chloro-5-(methylcarbamoyl)phenyl)boronicacid
• 3-Chloro-5-(methylcarbamoyl)phenylboronic acid
• B-[3-Chloro-5-[(methylamino)carbonyl]phenyl]boronic acid
• N-Methyl 3-borono-5-chlorobenzamide
• [3-Chloro-5-(methylcarbamoyl)phenyl]boronic acid
• Boronic acid, B-[3-chloro-5-[(methylamino)carbonyl]phenyl]-

(3-Chloro-5-(methylcarbamoyl)phenyl)boronic acid

CAS: 957120-51-3

• Formula: C₈H₉BClNO₃
• Purity: 95%
• Color and Shape: Solid
• Molecular weight: 213.426

3-Chloro-5-(methylcarbamoyl)benzeneboronic acid

CAS: 957120-51-3

• Formula: C₈H₉BClNO₃
• Purity: By hplc: 97% (Typical Value in Batch COA)
• Color and Shape: light yellow solid
• Molecular weight: 213.43g/mol

(3-Chloro-5-(methylcarbamoyl)phenyl)boronic acid

CAS: 957120-51-3

• Purity: 95.0%
• Molecular weight: 213.4199981689453

N-Methyl 3-borono-5-chlorobenzamide

CAS: 957120-51-3

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• Formula: C₈H₉BClNO₃
• Purity: Min. 95%
• Molecular weight: 213.43 g/mol