methyl 8-nitro-2,3-dihydro-1,4-benzodioxine-6-carboxylate
Chemical Structure Depiction of
methyl 8-nitro-2,3-dihydro-1,4-benzodioxine-6-carboxylate
methyl 8-nitro-2,3-dihydro-1,4-benzodioxine-6-carboxylate
Compound characteristics
| Compound ID: | 8020-7158 |
| Compound Name: | methyl 8-nitro-2,3-dihydro-1,4-benzodioxine-6-carboxylate |
| Molecular Weight: | 239.18 |
| Molecular Formula: | C10 H9 N O6 |
| Smiles: | COC(c1cc(c2c(c1)OCCO2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.103 |
| logD: | 1.103 |
| logSw: | -1.7664 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70 |
| InChI Key: | QRCUAZKIUQKUPB-UHFFFAOYSA-N |