Base information
| Cat. No. | |
| CAS No. | 106111-42-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H25NO2 |
| Molecular Weight | 311.418 |
| Exact Mass | 311.189 |
| XLogP3 | 3.83718 |
| Mr | 89.7388 |
| PSA | 61.09 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 51 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CCC1(O)CC[C@H]2[C@]1(C)CC=C1[C@H]2CCC2=C1CCC(=O)C2 |
