6-amino-2H-1,3-benzodioxole-5-carbonitrile
Chemical Structure Depiction of
6-amino-2H-1,3-benzodioxole-5-carbonitrile
6-amino-2H-1,3-benzodioxole-5-carbonitrile
Compound characteristics
| Compound ID: | 8014-2181 |
| Compound Name: | 6-amino-2H-1,3-benzodioxole-5-carbonitrile |
| Molecular Weight: | 162.14 |
| Molecular Formula: | C8 H6 N2 O2 |
| Smiles: | C1Oc2cc(C#N)c(cc2O1)N |
| Stereo: | ACHIRAL |
| logP: | 1.6383 |
| logD: | 1.6383 |
| logSw: | -2.1006 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.506 |
| InChI Key: | WHSLUSAPNOCFII-UHFFFAOYSA-N |