5-FLUORO-2-(TRIFLUOROMETHYL)BENZOIC ACID
- Product Name5-FLUORO-2-(TRIFLUOROMETHYL)BENZOIC ACID
- CAS654-99-9
- MFC8H4F4O2
- MW208.11
- EINECS626-221-8
- MOL File654-99-9.mol
Chemical Properties
| Melting point | 80-83 °C (lit.) |
| Boiling point | 238.2±40.0 °C(Predicted) |
| Density | 1.489±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | slightly sol. in Methanol |
| form | powder to crystal |
| pka | 2.89±0.36(Predicted) |
| color | White to Almost white |
| BRN | 2618195 |
| InChI | InChI=1S/C8H4F4O2/c9-4-1-2-6(8(10,11)12)5(3-4)7(13)14/h1-3H,(H,13,14) |
| InChIKey | BRFNBGWEOKQIND-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC(F)=CC=C1C(F)(F)F |
| CAS DataBase Reference | 654-99-9(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36-37/39-37 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 29163990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
