4,5-dimethoxy-6-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole
Chemical Structure Depiction of
4,5-dimethoxy-6-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole
4,5-dimethoxy-6-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole
Compound characteristics
| Compound ID: | 8019-8531 |
| Compound Name: | 4,5-dimethoxy-6-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole |
| Molecular Weight: | 267.24 |
| Molecular Formula: | C12 H13 N O6 |
| Smiles: | C/C(=C\c1cc2c(c(c1OC)OC)OCO2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2354 |
| logD: | 2.2354 |
| logSw: | -2.4106 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.11 |
| InChI Key: | SARJGJXAGRMIPC-UHFFFAOYSA-N |