2-methoxy-7-methyl-1,5-dinitro-3,7-diazabicyclo[3.3.1]non-2-ene
Chemical Structure Depiction of
2-methoxy-7-methyl-1,5-dinitro-3,7-diazabicyclo[3.3.1]non-2-ene
2-methoxy-7-methyl-1,5-dinitro-3,7-diazabicyclo[3.3.1]non-2-ene
Compound characteristics
| Compound ID: | S400-0022 |
| Compound Name: | 2-methoxy-7-methyl-1,5-dinitro-3,7-diazabicyclo[3.3.1]non-2-ene |
| Molecular Weight: | 258.23 |
| Molecular Formula: | C9 H14 N4 O5 |
| Smiles: | CN1CC2(CC(C1)(C(=NC2)OC)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.2589 |
| logD: | 0.2537 |
| logSw: | -0.308 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.075 |
| InChI Key: | GDWPZGPAGZCSGA-UHFFFAOYSA-N |