Base information
| Cat. No. | |
| CAS No. | 66869-70-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H9NO2 |
| Molecular Weight | 175.184 |
| Exact Mass | 175.063 |
| XLogP3 | 0.9962 |
| Mr | 47.878 |
| PSA | 39.19 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)C#Cc1ccccn1 |
