Diethyl ethane-1,2-disulfonate
TL;DR: Diethyl ethane-1,2-disulfonate (CAS 500692-41-1) is a chemical compound with molecular formula C6H14O6S2 and molecular weight 246.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl ethane-1,2-disulfonate
Also Known As: diethyl ethane-1,2-disulfonate, starbld0004324, 1,2-Ethanedisulfonic acid diethyl ester, 1,2-EthanedisulfonicAcidDiethylEster, ethane-1,2-disulfonic acid diethyl ester
| Molecular Formula | C6H14O6S2 |
|---|---|
| Molecular Weight | 246.02 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 246.02318 |
| Heavy Atoms | 14 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 500692-41-1 |
|---|---|
| SMILES | CCOS(=O)(=O)CCS(=O)(=O)OCC |
| InChIKey | XCEDLSQLKUOFPM-UHFFFAOYSA-N |
Product Overview
Diethyl ethane-1,2-disulfonate (CAS 500692-41-1), with molecular formula C6H14O6S2 and molecular weight 246.02 g/mol. IUPAC: diethyl ethane-1,2-disulfonate.
Chemical Property Profile of Diethyl ethane-1,2-disulfonate
Property Insights of Diethyl ethane-1,2-disulfonate
The XLogP value of -0.2 indicates that Diethyl ethane-1,2-disulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl ethane-1,2-disulfonate. Following Lipinski's Rule of Five, Diethyl ethane-1,2-disulfonate has 0 hydrogen bond donor(s) and 6 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 Diethyl ethane-1,2-disulfonate?
The CAS number of Diethyl ethane-1,2-disulfonate is 500692-41-1.
What is the molecular formula of Diethyl ethane-1,2-disulfonate?
The molecular formula of Diethyl ethane-1,2-disulfonate is C6H14O6S2.
What is the molecular weight of Diethyl ethane-1,2-disulfonate?
The molecular weight of Diethyl ethane-1,2-disulfonate is 246.02 g/mol.
Where can I buy Diethyl ethane-1,2-disulfonate?
You can request a quote for Diethyl ethane-1,2-disulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl ethane-1,2-disulfonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl ethane-1,2-disulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.