Base information
| Cat. No. | |
| CAS No. | 21396-42-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15NO |
| Molecular Weight | 189.254 |
| Exact Mass | 189.115 |
| XLogP3 | 2.6599 |
| Mr | 57.9707 |
| PSA | 29.1 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC(=CC(=O)C)NCc1ccccc1 |
