3-ethyl-1,5-dinitro-6-phenoxy-3-azabicyclo[3.3.1]non-6-ene
Chemical Structure Depiction of
3-ethyl-1,5-dinitro-6-phenoxy-3-azabicyclo[3.3.1]non-6-ene
3-ethyl-1,5-dinitro-6-phenoxy-3-azabicyclo[3.3.1]non-6-ene
Compound characteristics
| Compound ID: | 8012-2817 |
| Compound Name: | 3-ethyl-1,5-dinitro-6-phenoxy-3-azabicyclo[3.3.1]non-6-ene |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C16 H19 N3 O5 |
| Smiles: | CCN1CC2(CC=C(C(C2)(C1)[N+]([O-])=O)Oc1ccccc1)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0503 |
| logD: | 3.0498 |
| logSw: | -3.2885 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.738 |
| InChI Key: | SMLIOVJKYXYDQZ-UHFFFAOYSA-N |