![3-bromo-6H-anthra[1,9-cd]isoxazol-6-one structure](/static/products/7073/70730-91-5.webp)
3-bromo-6H-anthra[1,9-cd]isoxazol-6-one
12-bromo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one
Also Known As: Oprea1_139872|Oprea1_620419|3-bromo-6H-anthra[1,9-cd]isoxazol-6-one|3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one|AG-690/40097092|12-bromo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one
CAS: 70730-91-5
| Molecular Formula | C14H6BrNO2 |
|---|---|
| Molecular Weight | 298.9582 g/mol |
| LogP | 3.8017 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 298.9582 |
| Monoisotopic Mass | 298.9582 |
| Heavy Atoms | 18 |
| Complexity | 819.7721 |
Chemical Identifiers
| CAS Number | 70730-91-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C(=CC=C(C4=NO3)Br)C2=O |
Product Overview
3-bromo-6H-anthra[1,9-cd]isoxazol-6-one (CAS 70730-91-5), with molecular formula C14H6BrNO2 and molecular weight 298.9582 g/mol. IUPAC: 12-bromo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
3-bromo-6H-anthra[1,9-cd]isoxazol-6-one is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »