4-HYDROXY-3-METHOXYPHENYLACETONE
- Product Name4-HYDROXY-3-METHOXYPHENYLACETONE
- CAS2503-46-0
- MFC10H12O3
- MW180.2
- EINECS219-704-6
- MOL File2503-46-0.mol
Chemical Properties
| Boiling point | 126-127 °C/0.3 mmHg (lit.) |
| Density | 1.163 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMSO (Sparingly), Methanol (Slightly) |
| form | Oil |
| pka | 9.90±0.20(Predicted) |
| color | Pale Yellow to Yellow |
| Water Solubility | Soluble in alcohol and water, 1.101e+004 mg/L @ 25°C (est.). |
| Sensitive | Air Sensitive |
| Henry's Law Constant | 1.2×104 mol/(m3Pa) at 25℃, McFall et al. (2020) |
| InChI | 1S/C10H12O3/c1-7(11)5-8-3-4-9(12)10(6-8)13-2/h3-4,6,12H,5H2,1-2H3 |
| InChIKey | LFVCJQWZGDLHSD-UHFFFAOYSA-N |
| SMILES | COc1cc(CC(C)=O)ccc1O |
| LogP | 1.041 (est) |
| CAS DataBase Reference | 2503-46-0(CAS DataBase Reference) |
| EPA Substance Registry System | 2-Propanone, 1-(4-hydroxy-3-methoxyphenyl)- (2503-46-0) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HS Code | 29145090 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
