61079-72-9
| Name | 2,3,4-Trifluorobenzoic acid |
| CAS | 61079-72-9 |
| EINECS(EC#) | 612-077-3 |
| Molecular Formula | C7H3F3O2 |
| MDL Number | MFCD00061232 |
| Molecular Weight | 176.09 |
| MOL File | 61079-72-9.mol |
Chemical Properties
| Appearance | white to light yellow crystal powder |
| Melting point | 140-142 °C (lit.) |
| Boiling point | 245.3±35.0 °C(Predicted) |
| density | 1,404g/cm |
| refractive index | 1,482 |
| storage temp. | Sealed in dry,2-8°C |
| solubility | DMSO, Methanol |
| form | Solid |
| pka | 2.87±0.10(Predicted) |
| color | White |
| BRN | 7476020 |
| InChI | InChI=1S/C7H3F3O2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2H,(H,11,12) |
| InChIKey | WEPXLRANFJEOFZ-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=C(F)C(F)=C1F |
| CAS DataBase Reference | 61079-72-9(CAS DataBase Reference) |
| NIST Chemistry Reference | 2,3,4-Trifluorobenzoic acid(61079-72-9) |
| EPA Substance Registry System | Benzoic acid, 2,3,4-trifluoro- (61079-72-9) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| TSCA | TSCA listed |
| REACH Registrations | Inactive |
| HazardClass | IRRITANT |
| HS Code | 29163900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |