1-[2-(octane-1-sulfonyl)ethyl]pyridin-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-[2-(octane-1-sulfonyl)ethyl]pyridin-1-ium--bromide (1/1)
1-[2-(octane-1-sulfonyl)ethyl]pyridin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 8020-0539 |
| Compound Name: | 1-[2-(octane-1-sulfonyl)ethyl]pyridin-1-ium--bromide (1/1) |
| Molecular Weight: | 364.34 |
| Molecular Formula: | C15 H26 N O2 S |
| Salt: | Br- |
| Smiles: | CCCCCCCCS(CC[n+]1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1686 |
| logD: | 3.1686 |
| logSw: | -3.0116 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.5812 |
| InChI Key: | PAAIFKUWZTZZCI-UHFFFAOYSA-N |