138154-39-9
| Name | C 1311 |
| CAS | 138154-39-9 |
| Molecular Formula | C20H22N4O2 |
| MDL Number | MFCD00947296 |
| Molecular Weight | 350.41 |
| MOL File | 138154-39-9.mol |
Chemical Properties
| Boiling point | 605.8±65.0 °C(Predicted) |
| density | 1.32±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | DMSO: soluble10mg/mL (clear solution; warmed) |
| form | powder |
| pka | 8.35±0.20(Predicted) |
| color | white to beige |
| InChI | 1S/C20H22N4O2/c1-3-23(4-2)10-9-21-15-6-7-16-19-18(15)20(26)14-11-13(25)5-8-17(14)24(19)12-22-16/h5-8,11-12,21,25H,3-4,9-10H2,1-2H3 |
| InChIKey | CUNDRHORZHFPLY-UHFFFAOYSA-N |
| SMILES | CCN(CC)CCNc1ccc2ncn3-c4ccc(O)cc4C(=O)c1c23 |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302 |
| Precautionary statements | P264-P270-P301+P312-P330-P501 |
| Hazard Codes | Xn |
| Risk Statements | |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |