4-Methyl-3-(trifluoromethyl)benzoic acid
- Product Name4-Methyl-3-(trifluoromethyl)benzoic acid
- CAS261952-01-6
- MFC9H7F3O2
- MW204.15
- EINECS
- MOL File261952-01-6.mol
Chemical Properties
| Melting point | 182-186°C |
| Boiling point | 268.6±40.0 °C(Predicted) |
| Density | 1.345±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | soluble in Methanol |
| form | powder to crystal |
| pka | 3.94±0.10(Predicted) |
| color | White to Almost white |
| InChI | InChI=1S/C9H7F3O2/c1-5-2-3-6(8(13)14)4-7(5)9(10,11)12/h2-4H,1H3,(H,13,14) |
| InChIKey | CAPKAYDTKWGFQB-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=C(C)C(C(F)(F)F)=C1 |
| CAS DataBase Reference | 261952-01-6(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi,T+,Xn |
| Risk Statements | 36/37/38-26/27/28-36-22 |
| Safety Statements | 26-37/39-24/25-37 |
| HazardClass | IRRITANT |
| HS Code | 29163100 |
