(7-methoxy-2H-1,3-benzodioxol-5-yl)acetonitrile
Chemical Structure Depiction of
(7-methoxy-2H-1,3-benzodioxol-5-yl)acetonitrile
(7-methoxy-2H-1,3-benzodioxol-5-yl)acetonitrile
Compound characteristics
| Compound ID: | 8020-5791 |
| Compound Name: | (7-methoxy-2H-1,3-benzodioxol-5-yl)acetonitrile |
| Molecular Weight: | 191.18 |
| Molecular Formula: | C10 H9 N O3 |
| Smiles: | COc1cc(CC#N)cc2c1OCO2 |
| Stereo: | ACHIRAL |
| logP: | 1.3691 |
| logD: | 1.3691 |
| logSw: | -1.7907 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.16 |
| InChI Key: | GOCSYTLFCIVBIF-UHFFFAOYSA-N |