Base information
| Cat. No. | |
| CAS No. | 79200-56-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7NO |
| Molecular Weight | 109.126 |
| Exact Mass | 109.053 |
| XLogP3 | 0.3897 |
| Mr | 33.1707 |
| PSA | 29.1 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 16 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C1[C@H]2C=C[C@@H]1NC2=O |
