4-(4-heptylbicyclo[2.2.2]octan-1-yl)benzonitrile
Chemical Structure Depiction of
4-(4-heptylbicyclo[2.2.2]octan-1-yl)benzonitrile
4-(4-heptylbicyclo[2.2.2]octan-1-yl)benzonitrile
Compound characteristics
| Compound ID: | 1216-0077 |
| Compound Name: | 4-(4-heptylbicyclo[2.2.2]octan-1-yl)benzonitrile |
| Molecular Weight: | 309.49 |
| Molecular Formula: | C22 H31 N |
| Smiles: | CCCCCCCC12CCC(CC1)(CC2)c1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5551 |
| logD: | 6.5551 |
| logSw: | -5.9526 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 17.1358 |
| InChI Key: | FERAVBRGUZGMOU-UHFFFAOYSA-N |