4,7-dimethoxy-5,6-dinitro-2H-1,3-benzodioxole
Chemical Structure Depiction of
4,7-dimethoxy-5,6-dinitro-2H-1,3-benzodioxole
4,7-dimethoxy-5,6-dinitro-2H-1,3-benzodioxole
Compound characteristics
| Compound ID: | 8019-8522 |
| Compound Name: | 4,7-dimethoxy-5,6-dinitro-2H-1,3-benzodioxole |
| Molecular Weight: | 272.17 |
| Molecular Formula: | C9 H8 N2 O8 |
| Smiles: | COc1c(c(c(c2c1OCO2)OC)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9765 |
| logD: | 1.9765 |
| logSw: | -1.8829 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 97.716 |
| InChI Key: | AVODNUYNXLWFAD-UHFFFAOYSA-N |