Base information
| Cat. No. | |
| CAS No. | 7646-66-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9NO |
| Molecular Weight | 147.174 |
| Exact Mass | 147.068 |
| XLogP3 | 1.0803 |
| Mr | 46.1405 |
| PSA | 20.08 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=C(c1ccccc1)N1CC1 |
