Base information
| Cat. No. | |
| CAS No. | 1373227-29-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H10BrNO |
| Molecular Weight | 336.182 |
| Exact Mass | 334.995 |
| XLogP3 | 5.983 |
| Mr | 90.7827 |
| PSA | 28.93 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 35 |
| Ring number | 5 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)[nH]c1c2c2oc3c(c2cc1)cccc3 |
