4,7-dimethoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde
Chemical Structure Depiction of
4,7-dimethoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde
4,7-dimethoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde
Compound characteristics
| Compound ID: | 8020-2392 |
| Compound Name: | 4,7-dimethoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde |
| Molecular Weight: | 255.18 |
| Molecular Formula: | C10 H9 N O7 |
| Smiles: | COc1c(C=O)c(c(c2c1OCO2)OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.5383 |
| logD: | 1.5383 |
| logSw: | -1.5022 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.095 |
| InChI Key: | PAAPEFSDTHDZHB-UHFFFAOYSA-N |