2-Bromo-1-(5-methyl-3-phenylisoxazol-4-yl)ethan-1-one
- Product Name2-Bromo-1-(5-methyl-3-phenylisoxazol-4-yl)ethan-1-one
- CAS104777-39-1
- CBNumberCB5315318
- MFC12H10BrNO2
- MW280.12
- MDL NumberMFCD00173902
- MOL File104777-39-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 46 °C |
| Boiling point | 402.5±45.0 °C(Predicted) |
| Density | 1.461±0.06 g/cm3(Predicted) |
| Flash point | >110°C |
| pka | -4.52±0.50(Predicted) |
| form | powder |
| InChI | 1S/C12H10BrNO2/c1-8-11(10(15)7-13)12(14-16-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3 |
| InChIKey | QKOOGOQWNSWJFQ-UHFFFAOYSA-N |
| SMILES | Cc1onc(-c2ccccc2)c1C(=O)CBr |
| CAS DataBase Reference | 104777-39-1(CAS DataBase Reference) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H302 |
| Precautionary statements | P280-P305+P351+P338 |
| Hazard Codes | Xi,Xn |
| Risk Statements | 36/37/38-22 |
| Safety Statements | 26-36/37/39 |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| HS Code | 2934999090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |