Base information
| Cat. No. | |
| CAS No. | 77858-21-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14O5 |
| Molecular Weight | 238.237 |
| Exact Mass | 238.084 |
| XLogP3 | 1.8384 |
| Mr | 61.3443 |
| PSA | 83.83 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 31 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | O=Cc1c(OCCCCC(=O)O)cccc1O |
