Base information
| Cat. No. | |
| CAS No. | 112448-69-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13NO |
| Molecular Weight | 199.248 |
| Exact Mass | 199.1 |
| XLogP3 | 2.7611 |
| Mr | 60.2165 |
| PSA | 22 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C(n1cccc1)CCc1ccccc1 |
