566012

3-Acetamidophenylboronic acid

≥95%

• Synonym(s): 3-Acetamidobenzeneboronic acid
• Linear Formula: CH₃CONHC₆H₄B(OH)₂
• CAS Number: 78887-39-5
• Molecular Weight: 178.98
• Beilstein/REAXYS Number: 3278316
• MDL number: MFCD00236013
• UNSPSC Code: 12352103
• PubChem Substance ID: 24880272
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: ≥95%
• form: powder
• mp: 135 °C (lit.)
• SMILES string: CC(=O)Nc1cccc(c1)B(O)O
• InChI: 1S/C8H10BNO3/c1-6(11)10-8-4-2-3-7(5-8)9(12)13/h2-5,12-13H,1H3,(H,10,11)
• InChI key: IBTSWKLSEOGJGJ-UHFFFAOYSA-N

Description

Application

Reactant involved in:

• Suzuki-Miyaura coupling reactions
• Trifluoromethylation

Reactant involved in the synthesis of a variety of inhibitors including:

• NR2B subtype of NMDA receptor antagonists for antidepressant activity
• Biphenylylmethylimidazole derivatives for use as 17,20-lyase inhibitors
• (Indolyl)-3,5-substituted benzene analogs with antimitotic and antitumor activity
• Substituted pyrrolidines and tetrahydrofurans as AMPA receptor positive modulators

Other Notes

Contains varying amounts of anhydride.

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, type N95 (US)