3-Trifluoromethylphenol
- Product Name3-Trifluoromethylphenol
- CAS98-17-9
- MFC7H5F3O
- MW162.11
- EINECS202-645-5
- MOL File98-17-9.mol
Chemical Properties
| Melting point | −2-−1.8 °C(lit.) |
| Boiling point | 178-179 °C(lit.) |
| Density | 1.333 g/mL at 25 °C(lit.) |
| vapor pressure | 0.56 mm Hg ( 40 °C) |
| refractive index | n |
| Flash point | 165 °F |
| storage temp. | Inert atmosphere,Room Temperature |
| form | Liquid |
| pka | 8.68(at 25℃) |
| color | Clear yellow |
| Water Solubility | insoluble |
| BRN | 2045663 |
| InChI | 1S/C7H5F3O/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4,11H |
| InChIKey | UGEJOEBBMPOJMT-UHFFFAOYSA-N |
| SMILES | Oc1cccc(c1)C(F)(F)F |
| LogP | 2.95 at 25℃ |
| CAS DataBase Reference | 98-17-9(CAS DataBase Reference) |
| NIST Chemistry Reference | Phenol, 3-(trifluoromethyl)-(98-17-9) |
Safety Information
| Hazard Codes | Xi,T |
| Risk Statements | 37/38-41-34-24/25-36/37/38 |
| Safety Statements | 26-39-45-36/37/39 |
| WGK Germany | 3 |
| RTECS | GP3510000 |
| Hazard Note | Irritant |
| TSCA | TSCA listed |
| HazardClass | TOXIC |
| HazardClass | 8 |
| HS Code | 29081990 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
