3,5-Difluorobenzoic acid
- Product Name3,5-Difluorobenzoic acid
- CAS455-40-3
- MFC7H4F2O2
- MW158.1
- EINECS610-261-8
- MOL File455-40-3.mol
Chemical Properties
| Melting point | 121-123 °C (lit.) |
| Boiling point | 243.2±20.0 °C(Predicted) |
| Density | 1.3486 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Soluble), Methanol (Slightly) |
| pka | 3.52±0.10(Predicted) |
| form | Solid |
| color | White to Pale Yellow |
| BRN | 1940680 |
| InChI | InChI=1S/C7H4F2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11) |
| InChIKey | GONAVIHGXFBTOZ-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC(F)=CC(F)=C1 |
| CAS DataBase Reference | 455-40-3(CAS DataBase Reference) |
| EPA Substance Registry System | Benzoic acid, 3,5-difluoro- (455-40-3) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-37/39 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HazardClass | IRRITANT |
| HS Code | 29163990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
