TL;DR: 4-Vinyl-n-hexylpyridinium bromide (CAS 107455-35-6) is a chemical compound with molecular formula C13H20BrN and molecular weight 269.0779 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethenyl-1-hexylpyridin-1-ium bromide
Also Known As: 4-vinyl-n-hexylpyridinium bromide, 4-ethenyl-1-hexyl-pyridine Bromide, 1-Hexyl-4-vinylpyridin-1-iumbromide, 1-Hexyl-4-vinylpyridin-1-ium bromide
| Molecular Formula | C13H20BrN |
| Molecular Weight | 269.0779 g/mol |
| XLogP | 0.2014 |
| Topological Polar Surface Area (TPSA) | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.0779 Da |
| Heavy Atoms | 15 |
| Complexity | 145.0 |
| SMILES | CCCCCC[N+]1=CC=C(C=C1)C=C.[Br-] |
| InChIKey | IGCDKCMEOZGINK-UHFFFAOYSA-M |
The XLogP value of 0.2014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Vinyl-n-hexylpyridinium bromide. With a topological polar surface area (TPSA) of 3.9 Ų, 4-Vinyl-n-hexylpyridinium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Vinyl-n-hexylpyridinium bromide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Vinyl-n-hexylpyridinium bromide is 107455-35-6.
The molecular formula of 4-Vinyl-n-hexylpyridinium bromide is C13H20BrN.
The molecular weight of 4-Vinyl-n-hexylpyridinium bromide is 269.0779 g/mol.
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