6-amino-4,7-dimethoxy-2H-1,3-benzodioxole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4,7-dimethoxy-2H-1,3-benzodioxole-5-carbonitrile
6-amino-4,7-dimethoxy-2H-1,3-benzodioxole-5-carbonitrile
Compound characteristics
| Compound ID: | 8020-1861 |
| Compound Name: | 6-amino-4,7-dimethoxy-2H-1,3-benzodioxole-5-carbonitrile |
| Molecular Weight: | 222.2 |
| Molecular Formula: | C10 H10 N2 O4 |
| Smiles: | COc1c(C#N)c(c(c2c1OCO2)OC)N |
| Stereo: | ACHIRAL |
| logP: | 1.0452 |
| logD: | 1.0452 |
| logSw: | -0.7552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.599 |
| InChI Key: | HYEGAOGIGDAUGN-UHFFFAOYSA-N |