Base information
| Cat. No. | |
| CAS No. | 86702-80-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H17Br2NO2 |
| Molecular Weight | 403.109 |
| Exact Mass | 400.963 |
| XLogP3 | 5.34918 |
| Mr | 86.898 |
| PSA | 50.09 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 37 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCC(=O)Oc1c(Br)cc(cc1Br)C#N |
