(2-Acetamidophenyl)boronic acid , 98% , 169760-16-1

Synonym(s):
(2-Acetylaminophenyl)boronic acid;2-Carbamoylbenzeneboronic acid

CAS NO.：169760-16-1

Empirical Formula: C8H10BNO3

Molecular Weight: 178.98

MDL number: MFCD02179474

PRODUCT Properties

• Melting point: >300 °C
• Density: 1.23±0.1 g/cm3(Predicted)
• storage temp.: 2-8°C
• pka: 8.46±0.53(Predicted)
• form: solid
• color: off white
• InChI: 1S/C8H10BNO3/c1-6(11)10-8-5-3-2-4-7(8)9(12)13/h2-5,12-13H,1H3,(H,10,11)
• InChIKey: UMOPBIVXPOETPG-UHFFFAOYSA-N
• SMILES: CC(=O)Nc1ccccc1B(O)O
• CAS DataBase Reference: 169760-16-1(CAS DataBase Reference)

Description and Uses

Reactant for preparation of:

• Highly substituted acenes via rhodium-catalyzed oxidative coupling with alkynes
• Anticancer pyrimidines with multiple-kinase inhibitory effect
• 3,4-ring fused 7-azaindoles and deazapurines as potent JAK2 inhibitors
• Polycyclic azaindoles as JAK2 inhibitors
• ROS1 receptor tyrosine kinase inhibitors
• 2-aminopyrazolopyridines as Polo-like kinase 1 inhibitors

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P280a-P304+P340-P305+P351+P338-P405-P501a
• PPE: Eyeshields, Gloves, type N95 (US)
• Risk Statements: 36/37/38
• Safety Statements: 26-36/37/39-24/25
• WGK Germany: 3
• Hazard Note: Harmful
• HazardClass: IRRITANT
• HS Code: 29319090
• Storage Class: 11 - Combustible Solids