1,1'-bis{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-4,4'-bipyridin-1-ium--bromide (1/2)
Chemical Structure Depiction of
1,1'-bis{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-4,4'-bipyridin-1-ium--bromide (1/2)
1,1'-bis{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-4,4'-bipyridin-1-ium--bromide (1/2)
Compound characteristics
| Compound ID: | 1671-0003 |
| Compound Name: | 1,1'-bis{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-4,4'-bipyridin-1-ium--bromide (1/2) |
| Molecular Weight: | 894.96 |
| Molecular Formula: | C50 H74 N2 O2 |
| Salt: | 2Br- |
| Smiles: | CCC(C)(C)c1ccc(c(c1)C(C)(C)CC)OCCCC[n+]1ccc(cc1)c1cc[n+](CCCCOc2ccc(cc2C(C)(C)CC)C(C)(C)CC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 14.4852 |
| logD: | 14.4852 |
| logSw: | -5.9001 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 20.5176 |
| InChI Key: | RMMXTOLYCPOZAG-UHFFFAOYSA-N |