potassium--6,8-dichloro-3-nitrodibenzo[b,f]oxepine-1-carboxylate (1/1)
Chemical Structure Depiction of
potassium--6,8-dichloro-3-nitrodibenzo[b,f]oxepine-1-carboxylate (1/1)
potassium--6,8-dichloro-3-nitrodibenzo[b,f]oxepine-1-carboxylate (1/1)
Compound characteristics
| Compound ID: | 8017-1183 |
| Compound Name: | potassium--6,8-dichloro-3-nitrodibenzo[b,f]oxepine-1-carboxylate (1/1) |
| Molecular Weight: | 390.22 |
| Molecular Formula: | C15 H6 Cl2 N O5 |
| Salt: | K+ |
| Smiles: | C1=Cc2c(cc(cc2Oc2c1cc(cc2[Cl])[Cl])[N+]([O-])=O)C([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8188 |
| logD: | 4.8188 |
| logSw: | -4.529 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.857 |
| InChI Key: | DTGNSKYBBXTPTK-UHFFFAOYSA-M |