1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)
TL;DR: 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) (CAS 18684-11-2) is a chemical compound with molecular formula C22H49NO4S and molecular weight 423.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl sulfate;trimethyl(octadecyl)azanium
Also Known As: EMPIGEN CM, Stearyltrimonium methosulfate, STEARTRIMONIUM METHOSULFATE, Trimethylstearylammonium methyl sulfate, Trimethyl(octadecyl)ammonium methyl sulphate
| Molecular Formula | C22H49NO4S |
|---|---|
| Molecular Weight | 423.34 g/mol |
| LogP | 6.05 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 423.33823 |
| Heavy Atoms | 28 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 18684-11-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC[N+](C)(C)C.COS(=O)(=O)[O-] |
| InChIKey | WYTNTFGZBBTWNR-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) (CAS 18684-11-2), with molecular formula C22H49NO4S and molecular weight 423.34 g/mol. IUPAC: methyl sulfate;trimethyl(octadecyl)azanium.
Chemical Property Profile of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)
Property Insights of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)
The XLogP value of 6.05 indicates that 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1). Following Lipinski's Rule of Five, 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)?
The CAS number of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) is 18684-11-2.
What is the molecular formula of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)?
The molecular formula of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) is C22H49NO4S.
What is the molecular weight of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)?
The molecular weight of 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) is 423.34 g/mol.
Where can I buy 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)?
You can request a quote for 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Octadecanaminium, N,N,N-trimethyl-, methyl sulfate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.