Base information
| Cat. No. | |
| CAS No. | 6231-18-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9NO2 |
| Molecular Weight | 139.152 |
| Exact Mass | 139.063 |
| XLogP3 | 1.0988 |
| Mr | 37.221 |
| PSA | 31.35 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cccc(n1)OC |
