3-(Trifluoromethyl)pyridine-2-thiol
- Product Name3-(Trifluoromethyl)pyridine-2-thiol
- CAS104040-74-6
- MFC6H4F3NS
- MW179.16
- EINECS672-817-6
- MOL File104040-74-6.mol
Chemical Properties
| Melting point | 178-183 °C |
| Boiling point | 145.3±50.0 °C(Predicted) |
| Density | 1.43±0.1 g/cm3(Predicted) |
| storage temp. | Inert atmosphere,Room Temperature |
| form | solid |
| pka | 8.33±0.40(Predicted) |
| Appearance | Light yellow to brown Solid |
| InChI | 1S/C6H4F3NS/c7-6(8,9)4-2-1-3-10-5(4)11/h1-3H,(H,10,11) |
| InChIKey | ACGSRAAAQJSWLC-UHFFFAOYSA-N |
| SMILES | FC(F)(F)c1cccnc1S |
| CAS DataBase Reference | 104040-74-6(CAS DataBase Reference) |
Safety Information
| Hazard Codes | T,Xi |
| Risk Statements | 20/21/22-36/37/38-36-25 |
| Safety Statements | 22-24/25-45-26 |
| RIDADR | UN 2811 6.1 / PGIII |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 2933399990 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral Eye Irrit. 2 |