1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate
TL;DR: 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate (CAS 49706-67-4) is a chemical compound with molecular formula C21H47NO4S and molecular weight 409.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl sulfate;hexadecyl(trimethyl)azanium
Also Known As: Quarton 16 ES, hexadecyl-trimethyl-azanium, ethyl sulfate; hexadecyl(trimethyl)azanium, 1-HEXADECANAMINIUM, N,N,N-TRIMETHYL-, ETHYL SULFATE, ethyl sulfate,hexadecyl(trimethyl)azanium
| Molecular Formula | C21H47NO4S |
|---|---|
| Molecular Weight | 409.32 g/mol |
| LogP | 5.66 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 409.32257 |
| Heavy Atoms | 27 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 49706-67-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC[N+](C)(C)C.CCOS(=O)(=O)[O-] |
| InChIKey | JWJDGYODPGDPGX-UHFFFAOYSA-M |
Product Overview
1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate (CAS 49706-67-4), with molecular formula C21H47NO4S and molecular weight 409.32 g/mol. IUPAC: ethyl sulfate;hexadecyl(trimethyl)azanium.
Chemical Property Profile of 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate
Property Insights of 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate
The XLogP value of 5.66 indicates that 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate 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-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate. Following Lipinski's Rule of Five, 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate 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-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate?
The CAS number of 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate is 49706-67-4.
What is the molecular formula of 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate?
The molecular formula of 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate is C21H47NO4S.
What is the molecular weight of 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate?
The molecular weight of 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate is 409.32 g/mol.
Where can I buy 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate?
You can request a quote for 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexadecanaminium, N,N,N-trimethyl-, ethyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.