3-(1H-benzotriazol-1-yl)propanenitrile
Chemical Structure Depiction of
3-(1H-benzotriazol-1-yl)propanenitrile
3-(1H-benzotriazol-1-yl)propanenitrile
Compound characteristics
| Compound ID: | 0352-0635 |
| Compound Name: | 3-(1H-benzotriazol-1-yl)propanenitrile |
| Molecular Weight: | 172.19 |
| Molecular Formula: | C9 H8 N4 |
| Smiles: | C(Cn1c2ccccc2nn1)C#N |
| Stereo: | ACHIRAL |
| logP: | 0.835 |
| logD: | 0.835 |
| logSw: | -0.6599 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 43.406 |
| InChI Key: | ANMOBWUFLHVUBF-UHFFFAOYSA-N |