2-benzyl-4,8-diethoxy-1,3-dimethylcyclohepta[c]pyrrol-2-ium--perchlorate (1/1)
Chemical Structure Depiction of
2-benzyl-4,8-diethoxy-1,3-dimethylcyclohepta[c]pyrrol-2-ium--perchlorate (1/1)
2-benzyl-4,8-diethoxy-1,3-dimethylcyclohepta[c]pyrrol-2-ium--perchlorate (1/1)
Compound characteristics
| Compound ID: | 4861-0107 |
| Compound Name: | 2-benzyl-4,8-diethoxy-1,3-dimethylcyclohepta[c]pyrrol-2-ium--perchlorate (1/1) |
| Molecular Weight: | 435.9 |
| Molecular Formula: | C22 H26 N O2 |
| Salt: | ClO4- |
| Smiles: | CCOc1cccc(c2c1c(C)[n+](Cc1ccccc1)c2C)OCC |
| Stereo: | ACHIRAL |
| logP: | 5.3345 |
| logD: | 5.3345 |
| logSw: | -5.6514 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 15.8192 |
| InChI Key: | UPNKQTGOHSIONW-UHFFFAOYSA-N |