59985-82-9
| Name | 5-PHENYLISOXAZOLE-3-CARBALDEHYDE |
| CAS | 59985-82-9 |
| Molecular Formula | C10H7NO2 |
| MDL Number | MFCD06798102 |
| Molecular Weight | 173.17 |
| MOL File | 59985-82-9.mol |
Chemical Properties
| Melting point | 58-62 °C(lit.) |
| Boiling point | 361.5±30.0 °C(Predicted) |
| density | 1.216±0.06 g/cm3(Predicted) |
| form | solid |
| pka | -6.25±0.28(Predicted) |
| InChI | 1S/C10H7NO2/c12-7-9-6-10(13-11-9)8-4-2-1-3-5-8/h1-7H |
| InChIKey | QRHAQXZGSWFBOK-UHFFFAOYSA-N |
| SMILES | [H]C(=O)c1cc(on1)-c2ccccc2 |
Safety Data
| Symbol(GHS) |   GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H302-H315-H317-H319-H334-H335 |
| Precautionary statements | P280-P301+P312+P330-P302+P352-P305+P351+P338 |
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 2 |
| HazardClass | IRRITANT |
| HS Code | 2934999090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Resp. Sens. 1 Skin Irrit. 2 Skin Sens. 1 STOT SE 3 |