3-Cyanophthalide
- Product Name3-Cyanophthalide
- CAS27613-27-0
- MFC9H5NO2
- MW159.14
- EINECS
- MOL File27613-27-0.mol
Chemical Properties
| Melting point | 120-121 °C(Solv: ethanol (64-17-5); hexane (110-54-3)) |
| Boiling point | 394.1±42.0 °C(Predicted) |
| Density | 1.34±0.1 g/cm3(Predicted) |
| storage temp. | Store at room temperature |
| form | powder |
| Appearance | White to off-white Solid |
| BRN | 4292885 |
| InChI | 1S/C9H5NO2/c10-5-8-6-3-1-2-4-7(6)9(11)12-8/h1-4,8H |
| InChIKey | PUIVIZQHTBRFTR-UHFFFAOYSA-N |
| SMILES | O=C1OC(C#N)c2ccccc12 |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 22-43 |
| Safety Statements | 36/37 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Skin Sens. 1 |