Chemical Properties
| Melting point | 185-190°C |
| Boiling point | 564.6±50.0 °C(Predicted) |
| Density | 1.25±0.1 g/cm3(Predicted) |
| storage temp. | Storage temp. -20°C |
| pka | 3.61±0.70(Predicted) |
| form | solid |
| Appearance | Off-white to light yellow Solid |
| optical activity | [α]/D -97.0°, c = 0.5% in dichloromethane |
| InChI | 1S/C22H26N4O2/c1-13(2)19-11-27-21(25-19)17-9-5-7-15(23-17)16-8-6-10-18(24-16)22-26-20(12-28-22)14(3)4/h5-10,13-14,19-20H,11-12H2,1-4H3/t19-,20-/m1/s1 |
| InChIKey | NNCROLGXDLXLJM-WOJBJXKFSA-N |
| SMILES | CC(C)[C@H]1COC(=N1)c2cccc(n2)-c3cccc(n3)C4=N[C@H](CO4)C(C)C |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |