SINAPINALDEHYDE
- Product NameSINAPINALDEHYDE
- CAS4206-58-0
- MFC11H12O4
- MW208.21
- EINECS
- MOL File4206-58-0.mol
Chemical Properties
| Melting point | 104-106 °C(lit.) |
| Boiling point | 372.3±37.0 °C(Predicted) |
| Density | 1.195±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | Acetone (Slightly), Chloroform (Slightly), Methanol (Slightly) |
| pka | 9.67±0.36(Predicted) |
| form | Solid |
| color | Light Yellow to Yellow |
| Henry's Law Constant | 3.1×106 mol/(m3Pa) at 25℃, McFall et al. (2020) |
| Stability | Air Sensitive, Light Sensitive |
| InChI | 1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+ |
| InChIKey | CDICDSOGTRCHMG-ONEGZZNKSA-N |
| SMILES | [H]C(=O)\C([H])=C(/[H])c1cc(OC)c(O)c(OC)c1 |
| LogP | 1.686 (est) |
| EPA Substance Registry System | 2-Propenal, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, (2E)- (4206-58-0) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HS Code | 2912490090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
