TL;DR: Dimethyldiallylammonium (CAS 48042-45-1) is a chemical compound with molecular formula C8H16N+ and molecular weight 126.12827 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-bis(prop-2-enyl)azanium
Also Known As: dimethyldiallylammonium, Lectrapel, diallyldimethylammonium, Cat-floc, Polyquaternium 6
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H16N+ |
| Molecular Weight | 126.12827 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 126.12827 Da |
| Heavy Atoms | 9 |
| Complexity | 91.0 |
| SMILES | C[N+](C)(CC=C)CC=C |
| InChIKey | YIOJGTBNHQAVBO-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyldiallylammonium. With a topological polar surface area (TPSA) of 0.0 Ų, Dimethyldiallylammonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyldiallylammonium has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Dimethyldiallylammonium is 48042-45-1.
The molecular formula of Dimethyldiallylammonium is C8H16N+.
The molecular weight of Dimethyldiallylammonium is 126.12827 g/mol.
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