sodium--3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate (1/1)
Chemical Structure Depiction of
sodium--3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate (1/1)
sodium--3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate (1/1)
Compound characteristics
| Compound ID: | 0083-0079 |
| Compound Name: | sodium--3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate (1/1) |
| Molecular Weight: | 342.26 |
| Molecular Formula: | C14 H7 O7 S |
| Salt: | Na+ |
| Smiles: | c1ccc2C(c3c(cc(c(c3O)O)S([O-])(=O)=O)C(c2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1497 |
| logD: | -3.5698 |
| logSw: | -2.2718 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.553 |
| InChI Key: | JKYKXTRKURYNGW-UHFFFAOYSA-M |