Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)
TL;DR: Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) (CAS 42965-64-0) is a chemical compound with molecular formula C6H13ClO2S and molecular weight 184.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyloxyethyl(dimethyl)sulfanium chloride
Also Known As: Acetylsulfocholine, 2-Acetoxyethyldimethylsulfonium hydroxide, 2-acetyloxyethyl(dimethyl)sulfanium;chloride, 2-acetyloxyethyl(dimethyl)sulfanium chloride, (2-Acetoxy-aethyl)-dimethyl-sulfonium, chlorid
| Molecular Formula | C6H13ClO2S |
|---|---|
| Molecular Weight | 184.03 g/mol |
| LogP | -2.5686 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.03249 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 42965-64-0 |
|---|---|
| SMILES | CC(=O)OCC[S+](C)C.[Cl-] |
| InChIKey | IQZGKOPUDXOLAI-UHFFFAOYSA-M |
Product Overview
Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) (CAS 42965-64-0), with molecular formula C6H13ClO2S and molecular weight 184.03 g/mol. IUPAC: 2-acetyloxyethyl(dimethyl)sulfanium chloride.
Chemical Property Profile of Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)
Property Insights of Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)
The XLogP value of -2.5686 indicates that Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.3 Ų, Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) has 0 hydrogen bond donor(s) and 3 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, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)?
The CAS number of Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) is 42965-64-0.
What is the molecular formula of Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)?
The molecular formula of Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) is C6H13ClO2S.
What is the molecular weight of Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)?
The molecular weight of Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) is 184.03 g/mol.
Where can I buy Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)?
You can request a quote for Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Sulfonium, (2-(acetyloxy)ethyl)dimethyl-, chloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.