4-(Trifluoroacetyl)benzoic acid
- Product Name4-(Trifluoroacetyl)benzoic acid
- CAS58808-59-6
- MFC9H5F3O3
- MW218.13
- EINECS
- MOL File58808-59-6.mol
Chemical Properties
| Melting point | 178 °C |
| Boiling point | 313.5±42.0 °C(Predicted) |
| Density | 1.455±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| form | powder |
| pka | 3.40±0.10(Predicted) |
| color | White |
| Sensitive | Hygroscopic |
| BRN | 2728778 |
| InChI | 1S/C9H5F3O3/c10-9(11,12)7(13)5-1-3-6(4-2-5)8(14)15/h1-4H,(H,14,15) |
| InChIKey | WLTZCRCZDLLXQP-UHFFFAOYSA-N |
| SMILES | OC(=O)c1ccc(cc1)C(=O)C(F)(F)F |
| CAS DataBase Reference | 58808-59-6(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38-36 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 2918999090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
