3-(2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile
Chemical Structure Depiction of
3-(2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile
3-(2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile
Compound characteristics
| Compound ID: | 8018-9494 |
| Compound Name: | 3-(2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile |
| Molecular Weight: | 196.25 |
| Molecular Formula: | C13 H12 N2 |
| Smiles: | Cc1ccc(C)n1c1cccc(C#N)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.6615 |
| logD: | 2.6615 |
| logSw: | -2.5338 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 20.1835 |
| InChI Key: | NBJROBAUWGQJGQ-UHFFFAOYSA-N |