2,3,5-Trimethylphenol
- Product Name2,3,5-Trimethylphenol
- CAS697-82-5
- MFC9H12O
- MW136.19
- EINECS211-806-9
- MOL File697-82-5.mol
Chemical Properties
| Melting point | 92-95 °C (lit.) |
| Boiling point | 230-231 °C (lit.) |
| Density | 0,763 g/cm3 |
| vapor pressure | 9.75 mm Hg ( 60 °C) |
| refractive index | 1.5118 (estimate) |
| Flash point | 230-231°C |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | insoluble |
| pka | 10.53±0.15(Predicted) |
| form | Solid |
| color | White to Light yellow |
| Odor | woody |
| Water Solubility | insoluble |
| BRN | 2042210 |
| Henry's Law Constant | 1.2×101 mol/(m3Pa) at 25℃, Mackay et al. (2006) |
| InChI | 1S/C9H12O/c1-6-4-7(2)8(3)9(10)5-6/h4-5,10H,1-3H3 |
| InChIKey | OGRAOKJKVGDSFR-UHFFFAOYSA-N |
| SMILES | Cc1cc(C)c(C)c(O)c1 |
Safety Information
| Hazard Codes | C,Xi |
| Risk Statements | 34-36/37/38 |
| Safety Statements | 26-36/37/39-45-24/25 |
| RIDADR | UN 2430 8/PG 3 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HazardClass | 8 |
| PackingGroup | III |
| HS Code | 29071900 |
| Storage Class | 8B - Non-combustible corrosive hazardous materials |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 |
