3,4-Dihydroxythiophene-2,5-dicarboxylic acid
TL;DR: 3,4-Dihydroxythiophene-2,5-dicarboxylic acid (CAS 14282-58-7) is a chemical compound with molecular formula C6H4O6S and molecular weight 203.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydroxythiophene-2,5-dicarboxylic acid
Also Known As: 3,4-Dihydroxythiophene-2,5-dicarboxylic acid, 2,5-Thiophenedicarboxylic acid, 3,4-dihydroxy-, 2,5-dicarboxy-3,4-dihydroxythiophene, 2,5-Thiophenedicarboxylicacid, 3,4-dihydroxy-, 2,5-bis(dihydroxymethylidene)thiolane-3,4-dione
| Molecular Formula | C6H4O6S |
|---|---|
| Molecular Weight | 203.97 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.97285 |
| Heavy Atoms | 13 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 14282-58-7 |
|---|---|
| SMILES | C1(=C(SC(=C1O)C(=O)O)C(=O)O)O |
| InChIKey | YJQSEUFVWQCHCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dihydroxythiophene-2,5-dicarboxylic acid (CAS 14282-58-7), with molecular formula C6H4O6S and molecular weight 203.97 g/mol. IUPAC: 3,4-dihydroxythiophene-2,5-dicarboxylic acid.
Chemical Property Profile of 3,4-Dihydroxythiophene-2,5-dicarboxylic acid
Property Insights of 3,4-Dihydroxythiophene-2,5-dicarboxylic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydroxythiophene-2,5-dicarboxylic acid. The TPSA of 143.0 Ų indicates high polarity, suggesting 3,4-Dihydroxythiophene-2,5-dicarboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,4-Dihydroxythiophene-2,5-dicarboxylic acid has 4 hydrogen bond donor(s) and 7 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 3,4-Dihydroxythiophene-2,5-dicarboxylic acid?
The CAS number of 3,4-Dihydroxythiophene-2,5-dicarboxylic acid is 14282-58-7.
What is the molecular formula of 3,4-Dihydroxythiophene-2,5-dicarboxylic acid?
The molecular formula of 3,4-Dihydroxythiophene-2,5-dicarboxylic acid is C6H4O6S.
What is the molecular weight of 3,4-Dihydroxythiophene-2,5-dicarboxylic acid?
The molecular weight of 3,4-Dihydroxythiophene-2,5-dicarboxylic acid is 203.97 g/mol.
Where can I buy 3,4-Dihydroxythiophene-2,5-dicarboxylic acid?
You can request a quote for 3,4-Dihydroxythiophene-2,5-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydroxythiophene-2,5-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydroxythiophene-2,5-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.