5-nitrospiro[[1,3]benzodioxole-2,1'-cyclohexane]
Chemical Structure Depiction of
5-nitrospiro[[1,3]benzodioxole-2,1'-cyclohexane]
5-nitrospiro[[1,3]benzodioxole-2,1'-cyclohexane]
Compound characteristics
| Compound ID: | 8011-0044 |
| Compound Name: | 5-nitrospiro[[1,3]benzodioxole-2,1'-cyclohexane] |
| Molecular Weight: | 235.24 |
| Molecular Formula: | C12 H13 N O4 |
| Smiles: | C1CCC2(CC1)Oc1ccc(cc1O2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0709 |
| logD: | 3.0709 |
| logSw: | -3.3772 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.404 |
| InChI Key: | DGGQZKWSSUCGHQ-UHFFFAOYSA-N |