(6-bromo-1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl)acetic acid
Chemical Structure Depiction of
(6-bromo-1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl)acetic acid
(6-bromo-1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl)acetic acid
Compound characteristics
| Compound ID: | 8009-8835 |
| Compound Name: | (6-bromo-1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl)acetic acid |
| Molecular Weight: | 350.12 |
| Molecular Formula: | C10 H12 Br N3 O6 |
| Smiles: | C1C=C(C2(CC1(CN(CC(O)=O)C2)[N+]([O-])=O)[N+]([O-])=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.144 |
| logD: | -3.3801 |
| logSw: | -0.5419 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.959 |
| InChI Key: | LJZUOANBIHOMFH-UHFFFAOYSA-N |