3-butyl-1,5-dinitro-3-azabicyclo[3.3.1]nonan-7-one
Chemical Structure Depiction of
3-butyl-1,5-dinitro-3-azabicyclo[3.3.1]nonan-7-one
3-butyl-1,5-dinitro-3-azabicyclo[3.3.1]nonan-7-one
Compound characteristics
| Compound ID: | 8017-9812 |
| Compound Name: | 3-butyl-1,5-dinitro-3-azabicyclo[3.3.1]nonan-7-one |
| Molecular Weight: | 285.3 |
| Molecular Formula: | C12 H19 N3 O5 |
| Smiles: | CCCCN1CC2(CC(CC(C2)(C1)[N+]([O-])=O)=O)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1553 |
| logD: | 1.1073 |
| logSw: | -1.1563 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.438 |
| InChI Key: | ZXDXPSXWZVPTNE-UHFFFAOYSA-N |