1,2-Dithiolane-3,5-dicarboxylic acid
TL;DR: 1,2-Dithiolane-3,5-dicarboxylic acid (CAS 1126-47-2) is a chemical compound with molecular formula C5H6O4S2 and molecular weight 193.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dithiolane-3,5-dicarboxylic acid
Also Known As: dithiolane-3,5-dicarboxylic acid, NCIOpen2_000502, 1,2-Dithiolane-3,5-dicarbonic acid, 1,2-DITHIOLANE-3,5-DICARBOXYLIC ACID, 1,2-Dithiolane-3,5-dicarboxylicacid
| Molecular Formula | C5H6O4S2 |
|---|---|
| Molecular Weight | 193.97 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.97075 |
| Heavy Atoms | 11 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 1126-47-2 |
|---|---|
| SMILES | C1C(SSC1C(=O)O)C(=O)O |
| InChIKey | OBKGJBFGGPSACP-UHFFFAOYSA-N |
Product Overview
1,2-Dithiolane-3,5-dicarboxylic acid (CAS 1126-47-2), with molecular formula C5H6O4S2 and molecular weight 193.97 g/mol. IUPAC: dithiolane-3,5-dicarboxylic acid.
Chemical Property Profile of 1,2-Dithiolane-3,5-dicarboxylic acid
Property Insights of 1,2-Dithiolane-3,5-dicarboxylic acid
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dithiolane-3,5-dicarboxylic acid. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dithiolane-3,5-dicarboxylic acid. Following Lipinski's Rule of Five, 1,2-Dithiolane-3,5-dicarboxylic acid has 2 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-Dithiolane-3,5-dicarboxylic acid?
The CAS number of 1,2-Dithiolane-3,5-dicarboxylic acid is 1126-47-2.
What is the molecular formula of 1,2-Dithiolane-3,5-dicarboxylic acid?
The molecular formula of 1,2-Dithiolane-3,5-dicarboxylic acid is C5H6O4S2.
What is the molecular weight of 1,2-Dithiolane-3,5-dicarboxylic acid?
The molecular weight of 1,2-Dithiolane-3,5-dicarboxylic acid is 193.97 g/mol.
Where can I buy 1,2-Dithiolane-3,5-dicarboxylic acid?
You can request a quote for 1,2-Dithiolane-3,5-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dithiolane-3,5-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dithiolane-3,5-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.