TL;DR: Dimethylpalmitylstearylammonium (CAS 102394-98-9) is a chemical compound with molecular formula C36H76N+ and molecular weight 522.5978 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
hexadecyl-dimethyl-octadecylazanium
Also Known As: Dimethylpalmitylstearylammonium, DDAC, hexadecyldimethyloctadecylazanium, Dimethyloctadecylhexadecylaminium, Hexadecyloctadecyldimethylaminium
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C36H76N+ |
| Molecular Weight | 522.5978 g/mol |
| XLogP | 16.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 32 |
| Exact Mass | 522.5978 Da |
| Heavy Atoms | 37 |
| Complexity | 401.0 |
| SMILES | CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC |
| InChIKey | NACOEGDPOVPSIT-UHFFFAOYSA-N |
The XLogP value of 16.9 indicates that Dimethylpalmitylstearylammonium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Dimethylpalmitylstearylammonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethylpalmitylstearylammonium has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dimethylpalmitylstearylammonium is 102394-98-9.
The molecular formula of Dimethylpalmitylstearylammonium is C36H76N+.
The molecular weight of Dimethylpalmitylstearylammonium is 522.5978 g/mol.
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