sodium--7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonate (1/1)
Chemical Structure Depiction of
sodium--7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonate (1/1)
sodium--7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonate (1/1)
Compound characteristics
| Compound ID: | 8020-5804 |
| Compound Name: | sodium--7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonate (1/1) |
| Molecular Weight: | 283.19 |
| Molecular Formula: | C8 H6 N O7 S |
| Salt: | Na+ |
| Smiles: | C1COc2cc(c(cc2O1)[N+]([O-])=O)S([O-])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.9845 |
| logD: | -1.9845 |
| logSw: | -1.5051 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 91.556 |
| InChI Key: | OOBMMEJATOHMNV-UHFFFAOYSA-M |