(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)acetonitrile
Chemical Structure Depiction of
(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)acetonitrile
(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)acetonitrile
Compound characteristics
| Compound ID: | 8020-5787 |
| Compound Name: | (6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)acetonitrile |
| Molecular Weight: | 221.21 |
| Molecular Formula: | C11 H11 N O4 |
| Smiles: | COc1c(CC#N)cc2c(c1OC)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 1.7947 |
| logD: | 1.7947 |
| logSw: | -1.7904 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.964 |
| InChI Key: | MFQUTFNNFIXHHR-UHFFFAOYSA-N |