Aegelin
- Product NameAegelin
- CAS456-12-2
- MFC18H19NO3
- MW297.35
- EINECS1533716-785-6
- MOL File456-12-2.mol
Chemical Properties
| Melting point | 178-179℃ |
| Boiling point | 567.7±50.0 °C(Predicted) |
| Density | 1.178±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| form | powder to crystal |
| pka | 13.70±0.20(Predicted) |
| color | White to Light yellow |
| Major Application | pharmaceutical (small molecule) |
| InChI | 1S/C18H19NO3/c1-22-16-10-8-15(9-11-16)17(20)13-19-18(21)12-7-14-5-3-2-4-6-14/h2-12,17,20H,13H2,1H3,(H,19,21)/b12-7+ |
| InChIKey | QRFDENJATPJOKG-KPKJPENVSA-N |
| SMILES | N(CC(O)c2ccc(cc2)OC)C(=O)\C=C\c1ccccc1 |
Safety Information
| WGK Germany | WGK 3 |
| HS Code | 2924.29.7790 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |
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