1,2-Ethanedisulfonic acid, calcium salt (1:1)
TL;DR: 1,2-Ethanedisulfonic acid, calcium salt (1:1) (CAS 3118-70-5) is a chemical compound with molecular formula C2H4CaO6S2 and molecular weight 227.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium ethane-1,2-disulfonate
Also Known As: Calcium ethane-1,2-disulfonic acid, calcium ethane-1,2-disulfonate, 1,2-Ethanedisulfonic acid, calcium salt (1:1), RefChem:72083
| Molecular Formula | C2H4CaO6S2 |
|---|---|
| Molecular Weight | 227.91 g/mol |
| LogP | -2.304 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.90752 |
| Heavy Atoms | 11 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 3118-70-5 |
|---|---|
| SMILES | C(CS(=O)(=O)[O-])S(=O)(=O)[O-].[Ca+2] |
| InChIKey | APKKOFQXABAIOR-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Ethanedisulfonic acid, calcium salt (1:1) (CAS 3118-70-5), with molecular formula C2H4CaO6S2 and molecular weight 227.91 g/mol. IUPAC: calcium ethane-1,2-disulfonate.
Chemical Property Profile of 1,2-Ethanedisulfonic acid, calcium salt (1:1)
Property Insights of 1,2-Ethanedisulfonic acid, calcium salt (1:1)
The XLogP value of -2.304 indicates that 1,2-Ethanedisulfonic acid, calcium salt (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Ethanedisulfonic acid, calcium salt (1:1). Following Lipinski's Rule of Five, 1,2-Ethanedisulfonic acid, calcium salt (1:1) 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 1,2-Ethanedisulfonic acid, calcium salt (1:1)?
The CAS number of 1,2-Ethanedisulfonic acid, calcium salt (1:1) is 3118-70-5.
What is the molecular formula of 1,2-Ethanedisulfonic acid, calcium salt (1:1)?
The molecular formula of 1,2-Ethanedisulfonic acid, calcium salt (1:1) is C2H4CaO6S2.
What is the molecular weight of 1,2-Ethanedisulfonic acid, calcium salt (1:1)?
The molecular weight of 1,2-Ethanedisulfonic acid, calcium salt (1:1) is 227.91 g/mol.
Where can I buy 1,2-Ethanedisulfonic acid, calcium salt (1:1)?
You can request a quote for 1,2-Ethanedisulfonic acid, calcium salt (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Ethanedisulfonic acid, calcium salt (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Ethanedisulfonic acid, calcium salt (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.