2,5-Bis(trifluoromethyl)benzoic acid
- Product Name2,5-Bis(trifluoromethyl)benzoic acid
- CAS42580-42-7
- CBNumberCB3226744
- MFC9H4F6O2
- MW258.12
- EINECS625-656-0
- MDL NumberMFCD00013249
- MOL File42580-42-7.mol
Chemical Properties
| Melting point: | 78-80 °C(lit.) |
| Boiling point: | 248.5±40.0 °C(Predicted) |
| Density | 1.527±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| pka | 2.80±0.36(Predicted) |
| Appearance | White to off-white Solid |
| InChI | 1S/C9H4F6O2/c10-8(11,12)4-1-2-6(9(13,14)15)5(3-4)7(16)17/h1-3H,(H,16,17) |
| InChIKey | PINBPLCVZSKLTF-UHFFFAOYSA-N |
| SMILES | OC(=O)c1cc(ccc1C(F)(F)F)C(F)(F)F |
| CAS DataBase Reference | 42580-42-7(CAS DataBase Reference) |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P280a-P304+P340-P405-P501a-P261-P305+P351+P338 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Gloves | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 26-37/39 | |||||||||
| WGK Germany | 3 | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 2916399090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications |
Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
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| NFPA 704: |
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