1-Methyldodecyltrimethylammonium bromide
TL;DR: 1-Methyldodecyltrimethylammonium bromide (CAS 121537-47-1) is a chemical compound with molecular formula C16H36BrN and molecular weight 321.20312 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl(tridecan-2-yl)azanium bromide
Also Known As: Disperse Polyester Grey, 1-Methyldodecyltrimethylammonium bromide, trimethyl(tridecan-2-yl)azanium bromide, trimethyl(tridecan-2-yl)azanium,bromide, N,N,N-Trimethyltridecan-2-aminium bromide
Technical Specifications
| Molecular Formula | C16H36BrN |
| Molecular Weight | 321.20312 g/mol |
| XLogP | 2.006 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Exact Mass | 321.20312 Da |
| Heavy Atoms | 18 |
| Complexity | 157.0 |
| SMILES | CCCCCCCCCCCC(C)[N+](C)(C)C.[Br-] |
| InChIKey | CENRZAIXHQLWEU-UHFFFAOYSA-M |
Chemical Property Profile of 1-Methyldodecyltrimethylammonium bromide
Property Insights of 1-Methyldodecyltrimethylammonium bromide
The XLogP value of 2.006 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyldodecyltrimethylammonium bromide. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Methyldodecyltrimethylammonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyldodecyltrimethylammonium bromide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methyldodecyltrimethylammonium bromide?
The CAS number of 1-Methyldodecyltrimethylammonium bromide is 121537-47-1.
What is the molecular formula of 1-Methyldodecyltrimethylammonium bromide?
The molecular formula of 1-Methyldodecyltrimethylammonium bromide is C16H36BrN.
What is the molecular weight of 1-Methyldodecyltrimethylammonium bromide?
The molecular weight of 1-Methyldodecyltrimethylammonium bromide is 321.20312 g/mol.
Where can I buy 1-Methyldodecyltrimethylammonium bromide?
You can request a quote for 1-Methyldodecyltrimethylammonium bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyldodecyltrimethylammonium bromide?
Yes, CoreyChem provides custom synthesis services for 1-Methyldodecyltrimethylammonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.