Thiophene-3-carboxylic acid
TL;DR: Thiophene-3-carboxylic acid (CAS 88-13-1) is a chemical compound with molecular formula C5H4O2S and molecular weight 127.9932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
thiophene-3-carboxylic acid
Also Known As: Thiophene-3-carboxylic acid, 3-Thiophenecarboxylic acid, 3-Thenoic acid, 3-thiophenezoic acid, beta-Thiophenic acid
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H4O2S |
| Molecular Weight | 127.9932 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 127.9932 Da |
| Heavy Atoms | 8 |
| Complexity | 103.0 |
| SMILES | C1=CSC=C1C(=O)O |
| InChIKey | YNVOMSDITJMNET-UHFFFAOYSA-N |
Product Description
Applications: Thiophene-3-carboxylic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Thiophene-3-carboxylic acid is a heterocyclic building block identified by CAS number 88-13-1 and the molecular formula C5H4O2S and a molecular weight of 127.99 g/mol. Synonyms include Thiophene-3-carboxylic acid and 3-Thiophenecarboxylic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Thiophene-3-carboxylic acid
Property Insights of Thiophene-3-carboxylic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiophene-3-carboxylic acid. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiophene-3-carboxylic acid. Following Lipinski's Rule of Five, Thiophene-3-carboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Thiophene-3-carboxylic acid?
The CAS number of Thiophene-3-carboxylic acid is 88-13-1.
What is the molecular formula of Thiophene-3-carboxylic acid?
The molecular formula of Thiophene-3-carboxylic acid is C5H4O2S.
What is the molecular weight of Thiophene-3-carboxylic acid?
The molecular weight of Thiophene-3-carboxylic acid is 127.9932 g/mol.
What are the applications of Thiophene-3-carboxylic acid?
Thiophene-3-carboxylic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy Thiophene-3-carboxylic acid?
You can request a quote for Thiophene-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thiophene-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for Thiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.