![2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate structure](/static/products/4998/4998-50-9.webp)
2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate
TL;DR: 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate (CAS 4998-50-9) is a chemical compound with molecular formula C42H93N3O12S+2 and molecular weight 863.65 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecylazaniumyl]ethyl]-methylazaniumyl]ethyl]-methylazanium;methyl sulfate
Also Known As: 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate, Poly(oxy-1,2-ethanediyl), .alpha.-hydro-.omega.-hydroxy-, ether with N-[2-[bis(2-hydroxyethyl)methylammonio]ethyl]-N,N'-bis(hydroxyethyl)-N,N'-dimethyl-N'-octadecyl-1,2-ethanediaminium tris(methyl sulfate) (4:1) (salt), (C2-H4-O)mult-(C2-H4-O)mult-(C2-H4-O)mult-(C2-H4-O)mult-C33-H74-N3-O4.3C-H3-O4-S, bis[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecylazaniumyl]ethyl]-methylazaniumyl]ethyl]-methylazanium; methyl sulfate, Poly(oxy-1,2-ethanediyl), .alpha.-hydro-.omega.-hydroxy-, ether with N-[2-[bis(2-hydroxyethyl)methylammonio]ethyl]-N,N'-bis(hydroxyethyl)-N,N'-dimethyl-N'-octadecyl-1,2-ethanediaminium tris(methyl sulfate) (4:1)
| Molecular Formula | C42H93N3O12S+2 |
|---|---|
| Molecular Weight | 863.65 g/mol |
| LogP | 3.7163 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 43 |
| Exact Mass | 863.648 |
| Heavy Atoms | 58 |
| Complexity | 819.0 |
Chemical Identifiers
| CAS Number | 4998-50-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC[N+](C)(CC[N+](C)(CC[N+](C)(CCOCCO)CCOCCO)CCOCCO)CCOCCO.COS(=O)(=O)[O-] |
| InChIKey | IASJUZAFQXSJBU-UHFFFAOYSA-M |
Product Overview
2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate (CAS 4998-50-9), with molecular formula C42H93N3O12S+2 and molecular weight 863.65 g/mol. IUPAC: bis[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecylazaniumyl]ethyl]-methylazaniumyl]ethyl]-methylazanium;methyl sulfate.
Chemical Property Profile of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate
Property Insights of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate
The XLogP value of 3.7163 indicates that 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 193.0 Ų indicates high polarity, suggesting 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate?
The CAS number of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate is 4998-50-9.
What is the molecular formula of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate?
The molecular formula of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate is C42H93N3O12S+2.
What is the molecular weight of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate?
The molecular weight of 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate is 863.65 g/mol.
Where can I buy 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate?
You can request a quote for 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for 2-[bis[2-(2-hydroxyethoxy)ethyl]-methyl-ammonio]ethyl-[2-(2-hydroxyethoxy)ethyl]-[2-[2-(2-hydroxyethoxy)ethyl-methyl-octadecyl-ammonio]ethyl]-methyl-ammonium; methyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.