Base information
| Cat. No. | |
| CAS No. | 54885-00-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H11NO |
| Molecular Weight | 233.265 |
| Exact Mass | 233.084 |
| XLogP3 | 3.4658 |
| Mr | 71.6175 |
| PSA | 29.96 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 31 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=C(c1ccnc2c1cccc2)c1ccccc1 |
