Sulfonium, ethylmethyloctadecyl-, iodide
TL;DR: Sulfonium, ethylmethyloctadecyl-, iodide (CAS 29676-50-4) is a chemical compound with molecular formula C21H45IS and molecular weight 456.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl-methyl-octadecylsulfanium iodide
Also Known As: Sulfonium, iodide, Ethylmethyloctadecylsulfonium iodide, Sulfonium, ethylmethyloctadecyl-, iodide, Sulfonium, (ethylmethyl)octadecyl-, iodide, (Ethylmethyl)octadecylsulfonium iodide
| Molecular Formula | C21H45IS |
|---|---|
| Molecular Weight | 456.23 g/mol |
| LogP | 4.5199 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 18 |
| Exact Mass | 456.22867 |
| Heavy Atoms | 23 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 29676-50-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC[S+](C)CC.[I-] |
| InChIKey | FWCAEZMYKRVMPH-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulfonium, ethylmethyloctadecyl-, iodide (CAS 29676-50-4), with molecular formula C21H45IS and molecular weight 456.23 g/mol. IUPAC: ethyl-methyl-octadecylsulfanium iodide.
Chemical Property Profile of Sulfonium, ethylmethyloctadecyl-, iodide
Property Insights of Sulfonium, ethylmethyloctadecyl-, iodide
The XLogP value of 4.5199 indicates that Sulfonium, ethylmethyloctadecyl-, iodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, Sulfonium, ethylmethyloctadecyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfonium, ethylmethyloctadecyl-, iodide 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
Frequently Asked Questions
What is the CAS number of Sulfonium, ethylmethyloctadecyl-, iodide?
The CAS number of Sulfonium, ethylmethyloctadecyl-, iodide is 29676-50-4.
What is the molecular formula of Sulfonium, ethylmethyloctadecyl-, iodide?
The molecular formula of Sulfonium, ethylmethyloctadecyl-, iodide is C21H45IS.
What is the molecular weight of Sulfonium, ethylmethyloctadecyl-, iodide?
The molecular weight of Sulfonium, ethylmethyloctadecyl-, iodide is 456.23 g/mol.
Where can I buy Sulfonium, ethylmethyloctadecyl-, iodide?
You can request a quote for Sulfonium, ethylmethyloctadecyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfonium, ethylmethyloctadecyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Sulfonium, ethylmethyloctadecyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.