3,4,5-Trimethylphenol
- Product Name3,4,5-Trimethylphenol
- CAS527-54-8
- MFC9H12O
- MW136.19
- EINECS208-418-7
- MOL File527-54-8.mol
Chemical Properties
| Melting point | 94-98 °C |
| Boiling point | 251.8°C |
| Density | 0.9809 (estimate) |
| refractive index | 1.5084 (estimate) |
| pka | pK1:10.25 (25°C) |
| BRN | 1907246 |
| Henry's Law Constant | 3.4×101 mol/(m3Pa) at 25℃, Mackay et al. (2006) |
| InChI | 1S/C9H12O/c1-6-4-9(10)5-7(2)8(6)3/h4-5,10H,1-3H3 |
| InChIKey | FDQQNNZKEJIHMS-UHFFFAOYSA-N |
| SMILES | Cc1cc(O)cc(C)c1C |
| LogP | 2.911 (est) |
| EPA Substance Registry System | 3,4,5-Trimethylphenol (527-54-8) |
Safety Information
| Hazard Codes | C |
| Risk Statements | 34 |
| Safety Statements | 26-28-36/37/39-45 |
| RIDADR | UN 2430 8/PG 3 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HazardClass | 8 |
| PackingGroup | III |
| Storage Class | 8A - Combustible corrosive hazardous materials |
| Hazard Classifications | Skin Corr. 1B |