Base information
| Cat. No. | |
| CAS No. | 621-79-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9NO |
| Molecular Weight | 147.174 |
| Exact Mass | 147.068 |
| XLogP3 | 1.8854 |
| Mr | 44.2474 |
| PSA | 43.09 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NC(=O)C=Cc1ccccc1 |
