4-(Trifluoromethyl)benzoic acid
- Product Name4-(Trifluoromethyl)benzoic acid
- CAS455-24-3
- MFC8H5F3O2
- MW190.12
- EINECS207-242-8
- MOL File455-24-3.mol
Chemical Properties
| Melting point | 219-220 °C(lit.) |
| Boiling point | 247°C 753mm |
| Density | 1.3173 (estimate) |
| Flash point | 247°C/753mm |
| storage temp. | Sealed in dry,Room Temperature |
| pka | 3.69±0.10(Predicted) |
| form | Fine Crystalline Powder |
| color | White to slight gray |
| Water Solubility | Soluble in water. |
| BRN | 2049241 |
| InChI | InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13) |
| InChIKey | SWKPKONEIZGROQ-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=C(C(F)(F)F)C=C1 |
| CAS DataBase Reference | 455-24-3(CAS DataBase Reference) |
| NIST Chemistry Reference | «ALPHA»,«alpha»,«alpha»-trifluoro-p-toluic acid(455-24-3) |
| EPA Substance Registry System | Benzoic acid, 4-(trifluoromethyl)- (455-24-3) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36/37-24/25 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HazardClass | IRRITANT |
| HS Code | 29163900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
