(2-Ethanesulfonyl-ethylsulfanyl)-acetic acid
TL;DR: (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid (CAS 499987-50-7) is a chemical compound with molecular formula C6H12O4S2 and molecular weight 212.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-ethylsulfonylethylsulfanyl)acetic acid
Also Known As: (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid, 2-(2-ethylsulfonylethylsulfanyl)acetic acid, BAS 01053291, {[2-(ethanesulfonyl)ethyl]sulfanyl}acetic acid, 2-[2-(ethylsulfonyl)ethylthio]acetic acid
| Molecular Formula | C6H12O4S2 |
|---|---|
| Molecular Weight | 212.02 g/mol |
| LogP | 0.2389 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 212.0177 |
| Heavy Atoms | 12 |
| Complexity | 231.93265 |
Chemical Identifiers
| CAS Number | 499987-50-7 |
|---|---|
| SMILES | CCS(=O)(=O)CCSCC(=O)O |
Product Overview
(2-Ethanesulfonyl-ethylsulfanyl)-acetic acid (CAS 499987-50-7), with molecular formula C6H12O4S2 and molecular weight 212.02 g/mol. IUPAC: 2-(2-ethylsulfonylethylsulfanyl)acetic acid.
Chemical Property Profile of (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid
Property Insights of (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid
The XLogP value of 0.2389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid. Following Lipinski's Rule of Five, (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid has 1 hydrogen bond donor(s) and 4 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-Ethanesulfonyl-ethylsulfanyl)-acetic acid?
The CAS number of (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid is 499987-50-7.
What is the molecular formula of (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid?
The molecular formula of (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid is C6H12O4S2.
What is the molecular weight of (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid?
The molecular weight of (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid is 212.02 g/mol.
Where can I buy (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid?
You can request a quote for (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-Ethanesulfonyl-ethylsulfanyl)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.