2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid
TL;DR: 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid (CAS 53501-91-0) is a chemical compound with molecular formula C4H11O3S2+ and molecular weight 171.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl(2-sulfoethyl)sulfanium
Also Known As: dimethyl(2-sulfoethyl)sulfanium, dimethyl(2-sulfoethyl)sulfonium, 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid, 2-(Dimethyl-.lambda.~4~-sulfanyl)ethanesulfonic acid
| Molecular Formula | C4H11O3S2+ |
|---|---|
| Molecular Weight | 171.01 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 63.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.01497 |
| Heavy Atoms | 9 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 53501-91-0 |
|---|---|
| SMILES | C[S+](C)CCS(=O)(=O)O |
| InChIKey | DGZZGIFKSGKPRY-UHFFFAOYSA-O |
Product Overview
2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid (CAS 53501-91-0), with molecular formula C4H11O3S2+ and molecular weight 171.01 g/mol. IUPAC: dimethyl(2-sulfoethyl)sulfanium.
Chemical Property Profile of 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid
Property Insights of 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid
The XLogP value of -0.2 indicates that 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid. Following Lipinski's Rule of Five, 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid has 1 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 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid?
The CAS number of 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid is 53501-91-0.
What is the molecular formula of 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid?
The molecular formula of 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid is C4H11O3S2+.
What is the molecular weight of 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid?
The molecular weight of 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid is 171.01 g/mol.
Where can I buy 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid?
You can request a quote for 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethyl-lambda(4)-sulfanyl)ethanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.