6-Acetylthiohexanoic acid 97
- Product Name6-Acetylthiohexanoic acid 97
- CAS80441-57-2
- MFC8H14O3S
- MW190.26
- EINECS
- MOL File80441-57-2.mol
Chemical Properties
| Boiling point | 319.3±25.0 °C(Predicted) |
| Density | 1.144 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point | >230 °F |
| pka | 4.73±0.10(Predicted) |
| InChI | 1S/C8H14O3S/c1-7(9)12-6-4-2-3-5-8(10)11/h2-6H2,1H3,(H,10,11) |
| InChIKey | PIFIISOIFYMVLS-UHFFFAOYSA-N |
| SMILES | CC(=O)SCCCCCC(O)=O |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| RIDADR | UN 3334 |
| WGK Germany | 3 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |