CTK4G0966
TL;DR: CTK4G0966 (CAS 28173-47-9) is a chemical compound with molecular formula C14H28I2N2O4 and molecular weight 542.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-[4-oxo-4-[2-(trimethylazaniumyl)ethoxy]but-2-enoyl]oxyethyl]azanium diiodide
Also Known As: Choline, iodide, maleate (2:1), Choline, iodide,maleate (2:1) (8CI), (2-Hydroxyethyl)trimethylammonium iodide maleate (2:1), Ammonium, (2-hydroxyethyl)trimethyl-, iodide, maleate (2:1)
| Molecular Formula | C14H28I2N2O4 |
|---|---|
| Molecular Weight | 542.01 g/mol |
| LogP | -5.9506 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 542.01385 |
| Heavy Atoms | 22 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 28173-47-9 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)C=CC(=O)OCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | UCTSUCNPHOPEPQ-UHFFFAOYSA-L |
Product Overview
CTK4G0966 (CAS 28173-47-9), with molecular formula C14H28I2N2O4 and molecular weight 542.01 g/mol. IUPAC: trimethyl-[2-[4-oxo-4-[2-(trimethylazaniumyl)ethoxy]but-2-enoyl]oxyethyl]azanium diiodide.
Chemical Property Profile of CTK4G0966
Property Insights of CTK4G0966
The XLogP value of -5.9506 indicates that CTK4G0966 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.6 Ų, CTK4G0966 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK4G0966 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK4G0966?
The CAS number of CTK4G0966 is 28173-47-9.
What is the molecular formula of CTK4G0966?
The molecular formula of CTK4G0966 is C14H28I2N2O4.
What is the molecular weight of CTK4G0966?
The molecular weight of CTK4G0966 is 542.01 g/mol.
Where can I buy CTK4G0966?
You can request a quote for CTK4G0966 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4G0966?
Yes, KEHONG BIO provides custom synthesis services for CTK4G0966 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.