3-(2H-1,3-benzodioxol-5-yl)cyclopropane-1,1,2,2-tetracarbonitrile
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)cyclopropane-1,1,2,2-tetracarbonitrile
3-(2H-1,3-benzodioxol-5-yl)cyclopropane-1,1,2,2-tetracarbonitrile
Compound characteristics
| Compound ID: | 8018-3997 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)cyclopropane-1,1,2,2-tetracarbonitrile |
| Molecular Weight: | 262.22 |
| Molecular Formula: | C14 H6 N4 O2 |
| Smiles: | C1Oc2ccc(cc2O1)C1C(C#N)(C#N)C1(C#N)C#N |
| Stereo: | ACHIRAL |
| logP: | 1.9491 |
| logD: | 1.949 |
| logSw: | -2.1933 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 85.83 |
| InChI Key: | YEDFUKJABNHFLN-UHFFFAOYSA-N |