3-(2H-1,3-benzodioxol-5-yl)-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-8-methoxy-2H-1-benzopyran-2-one
3-(2H-1,3-benzodioxol-5-yl)-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 4466-0409 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 296.28 |
| Molecular Formula: | C17 H12 O5 |
| Smiles: | COc1cccc2C=C(C(=O)Oc12)c1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.154 |
| logD: | 3.154 |
| logSw: | -3.2906 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.319 |
| InChI Key: | PZDUELMKZFMVKX-UHFFFAOYSA-N |