Chemical Properties
| Boiling point | 460.4±45.0 °C(Predicted) |
| Density | 1.487 |
| storage temp. | 2-8°C |
| solubility | DMSO: >5mg/mL |
| pka | 4.56±0.26(Predicted) |
| form | powder |
| color | off-white to tan |
| InChI | 1S/C17H10ClFN6/c18-10-1-2-13(19)12(9-10)15-24-16-14(21-7-8-22-16)17(25-15)23-11-3-5-20-6-4-11/h1-9H,(H,20,22,23,24,25) |
| InChIKey | BERLXWPRSBJFHO-UHFFFAOYSA-N |
| SMILES | Fc1ccc(Cl)cc1-c2nc(Nc3ccncc3)c4nccnc4n2 |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 22 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |
