4-(1H-benzotriazol-1-yl)benzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-(1H-benzotriazol-1-yl)benzene-1,2-dicarbonitrile
4-(1H-benzotriazol-1-yl)benzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8007-3025 |
| Compound Name: | 4-(1H-benzotriazol-1-yl)benzene-1,2-dicarbonitrile |
| Molecular Weight: | 245.24 |
| Molecular Formula: | C14 H7 N5 |
| Smiles: | C(c1ccc(cc1C#N)n1c2ccccc2nn1)#N |
| Stereo: | ACHIRAL |
| logP: | 1.9411 |
| logD: | 1.9411 |
| logSw: | -2.221 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 59.913 |
| InChI Key: | HABCUEXJOHGRQG-UHFFFAOYSA-N |