TL;DR: N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium (CAS 1040849-27-1) is a chemical compound with molecular formula C15H33BrN+ and molecular weight 306.17963 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromopropyl(tributyl)azanium
Also Known As: 3-bromopropyl(tributyl)azanium, 3-bromopropyl-tributyl-azanium, N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium
| Molecular Formula | C15H33BrN+ |
| Molecular Weight | 306.17963 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 12 |
| Exact Mass | 306.17963 Da |
| Heavy Atoms | 17 |
| Complexity | 137.0 |
| SMILES | CCCC[N+](CCCC)(CCCC)CCCBr |
| InChIKey | LNUIDVVKZBNILX-UHFFFAOYSA-N |
The XLogP value of 5.1 indicates that N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium is 1040849-27-1.
The molecular formula of N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium is C15H33BrN+.
The molecular weight of N-(3-Bromopropyl)-N,N-dibutylbutan-1-aminium is 306.17963 g/mol.
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