5-(4-Fluorophenyl)cyclohexane-1,3-dione
- Product Name5-(4-Fluorophenyl)cyclohexane-1,3-dione
- CAS55579-72-1
- MFC12H11FO2
- MW206.21
- EINECS
- MOL File55579-72-1.mol
Chemical Properties
| Melting point | 186-189 °C(lit.) |
| Boiling point | 353.8±42.0 °C(Predicted) |
| Density | 1.228±0.06 g/cm3(Predicted) |
| pka | 4.90±0.20(Predicted) |
| form | crystalline powder |
| color | Yellow |
| InChI | 1S/C12H11FO2/c13-10-3-1-8(2-4-10)9-5-11(14)7-12(15)6-9/h1-4,9H,5-7H2 |
| InChIKey | LBTLJACXBCUFEF-UHFFFAOYSA-N |
| SMILES | Fc1ccc(cc1)C2CC(=O)CC(=O)C2 |
| CAS DataBase Reference | 55579-72-1(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36/37/39 |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| HS Code | 2914790090 |
| Storage Class | 11 - Combustible Solids |