4-Methoxy-3-methylbenzoic acid
- Product Name4-Methoxy-3-methylbenzoic acid
- CAS6880-04-2
- MFC9H10O3
- MW166.17
- EINECS674-106-6
- MOL File6880-04-2.mol
Chemical Properties
| Melting point | 177-181 °C(lit.) |
| Boiling point | 285.3±20.0 °C(Predicted) |
| Density | 1.168±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Soluble to 100 mM in DMSO and to 100 mM in ethanol |
| form | powder to crystaline |
| pka | 4.54±0.10(Predicted) |
| color | White to Light yellow |
| InChI | 1S/C9H10O3/c1-6-5-7(9(10)11)3-4-8(6)12-2/h3-5H,1-2H3,(H,10,11) |
| InChIKey | DNMUMZLKDOZMEY-UHFFFAOYSA-N |
| SMILES | COc1ccc(cc1C)C(O)=O |
| CAS DataBase Reference | 6880-04-2(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 36/37/38-22 |
| Safety Statements | 26-36/37/39 |
| WGK Germany | 3 |
| HS Code | 29163900 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 4 Oral |
