9,11-dinitrobenzo[b]naphtho[1,2-f]oxepine
Chemical Structure Depiction of
9,11-dinitrobenzo[b]naphtho[1,2-f]oxepine
9,11-dinitrobenzo[b]naphtho[1,2-f]oxepine
Compound characteristics
| Compound ID: | 8009-3818 |
| Compound Name: | 9,11-dinitrobenzo[b]naphtho[1,2-f]oxepine |
| Molecular Weight: | 334.29 |
| Molecular Formula: | C18 H10 N2 O5 |
| Smiles: | C1=Cc2c(ccc3ccccc23)Oc2cc(cc(c12)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8028 |
| logD: | 4.8028 |
| logSw: | -5.8149 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.574 |
| InChI Key: | XIHJOBWXVAGSCV-UHFFFAOYSA-N |