488-17-5
| Name | 3-Methylcatechol |
| CAS | 488-17-5 |
| EINECS(EC#) | 207-672-6 |
| Molecular Formula | C7H8O2 |
| MDL Number | MFCD00016435 |
| Molecular Weight | 124.14 |
| MOL File | 488-17-5.mol |
Chemical Properties
| Appearance | brown-grey crystalline powder |
| Melting point | 65-68 °C(lit.) |
| Boiling point | 241 °C(lit.) |
| density | 1.1006 (rough estimate) |
| refractive index | 1.5286 (estimate) |
| Fp | 140 °C |
| storage temp. | 2-8°C |
| solubility | Acetonitrile (Slightly), Benzene (Slightly), Chloroform (Slightly) |
| form | Solid |
| pka | 9.91±0.10(Predicted) |
| color | Grey |
| Water Solubility | soluble |
| Usage | A novel enzyme inhibitor agent |
| BRN | 774602 |
| InChI | 1S/C7H8O2/c1-5-3-2-4-6(8)7(5)9/h2-4,8-9H,1H3 |
| InChIKey | PGSWEKYNAOWQDF-UHFFFAOYSA-N |
| SMILES | Cc1cccc(O)c1O |
| LogP | 1.340 (est) |
| CAS DataBase Reference | 488-17-5(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 2811 |
| WGK Germany | 3 |
| RTECS | UX1910000 |
| TSCA | Yes |
| HazardClass | 6.1(b) |
| PackingGroup | III |
| HS Code | 29072990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 Skin Sens. 1 STOT SE 3 |
| Safety Profile |
