sodium--3-nitro-1,4-dioxo-1,4-dihydronaphthalen-2-olate (1/1)
Chemical Structure Depiction of
sodium--3-nitro-1,4-dioxo-1,4-dihydronaphthalen-2-olate (1/1)
sodium--3-nitro-1,4-dioxo-1,4-dihydronaphthalen-2-olate (1/1)
Compound characteristics
| Compound ID: | 0828-0078 |
| Compound Name: | sodium--3-nitro-1,4-dioxo-1,4-dihydronaphthalen-2-olate (1/1) |
| Molecular Weight: | 241.13 |
| Molecular Formula: | C10 H4 N O5 |
| Salt: | Na+ |
| Smiles: | c1ccc2C(C(=C(C(c2c1)=O)[N+]([O-])=O)[O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9255 |
| logD: | 0.9255 |
| logSw: | -2.3313 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.823 |
| InChI Key: | MMIBDNPEOXEBAU-UHFFFAOYSA-M |