7-methoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde
Chemical Structure Depiction of
7-methoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde
7-methoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde
Compound characteristics
| Compound ID: | 8020-4816 |
| Compound Name: | 7-methoxy-6-nitro-2H-1,3-benzodioxole-5-carbaldehyde |
| Molecular Weight: | 225.15 |
| Molecular Formula: | C9 H7 N O6 |
| Smiles: | COc1c(c(C=O)cc2c1OCO2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4578 |
| logD: | 1.4578 |
| logSw: | -1.6942 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.694 |
| InChI Key: | XZNXGGHGXIAORV-UHFFFAOYSA-N |