Base information
| Cat. No. | |
| CAS No. | 100874-09-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H10BrNO2 |
| Molecular Weight | 304.139 |
| Exact Mass | 302.989 |
| XLogP3 | 3.1561 |
| Mr | 76.734 |
| PSA | 37.38 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CCN1C(=O)c2cccc3c2c(C1=O)ccc3Br |
