Base information
| Cat. No. | |
| CAS No. | 1111236-54-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13NO3 |
| Molecular Weight | 183.204 |
| Exact Mass | 183.09 |
| XLogP3 | 1.3595 |
| Mr | 49.9582 |
| PSA | 64.71 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1c(OC)cc(cc1CO)N |
