2,5-Thiophenedicarboxylic acid
TL;DR: 2,5-Thiophenedicarboxylic acid (CAS 4282-31-9) is a chemical compound with molecular formula C6H4O4S and molecular weight 171.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thiophene-2,5-dicarboxylic acid
Also Known As: 2,5-Thiophenedicarboxylic acid, THIOPHENE-2,5-DICARBOXYLIC ACID, 2,5-Dicarboxythiophene, Raltitrexed Impurity 5, 2,5-Thiophene dicarboxylic acid
| Molecular Formula | C6H4O4S |
|---|---|
| Molecular Weight | 171.98 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.98303 |
| Heavy Atoms | 11 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 4282-31-9 |
|---|---|
| SMILES | C1=C(SC(=C1)C(=O)O)C(=O)O |
| InChIKey | YCGAZNXXGKTASZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Thiophenedicarboxylic acid (CAS 4282-31-9), with molecular formula C6H4O4S and molecular weight 171.98 g/mol. IUPAC: thiophene-2,5-dicarboxylic acid.
Chemical Property Profile of 2,5-Thiophenedicarboxylic acid
Property Insights of 2,5-Thiophenedicarboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Thiophenedicarboxylic acid. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Thiophenedicarboxylic acid. Following Lipinski's Rule of Five, 2,5-Thiophenedicarboxylic acid has 2 hydrogen bond donor(s) and 5 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 2,5-Thiophenedicarboxylic acid?
The CAS number of 2,5-Thiophenedicarboxylic acid is 4282-31-9.
What is the molecular formula of 2,5-Thiophenedicarboxylic acid?
The molecular formula of 2,5-Thiophenedicarboxylic acid is C6H4O4S.
What is the molecular weight of 2,5-Thiophenedicarboxylic acid?
The molecular weight of 2,5-Thiophenedicarboxylic acid is 171.98 g/mol.
Where can I buy 2,5-Thiophenedicarboxylic acid?
You can request a quote for 2,5-Thiophenedicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Thiophenedicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Thiophenedicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.