Thioacetylthioglycolic acid
TL;DR: Thioacetylthioglycolic acid (CAS 21224-41-9) is a chemical compound with molecular formula C4H6O2S2 and molecular weight 149.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethanethioylsulfanylacetic acid
Also Known As: Thioacetylthioglycolic acid, (Ethanethioylsulfanyl)acetic acid, thioacetylthioglycollic acid, (Thioacylthio)essigsaeure, 2-ethanethioylsulfanylacetic acid
| Molecular Formula | C4H6O2S2 |
|---|---|
| Molecular Weight | 149.98 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 94.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 149.98093 |
| Heavy Atoms | 8 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 21224-41-9 |
|---|---|
| SMILES | CC(=S)SCC(=O)O |
| InChIKey | NMVORHZMMQUABS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thioacetylthioglycolic acid (CAS 21224-41-9), with molecular formula C4H6O2S2 and molecular weight 149.98 g/mol. IUPAC: 2-ethanethioylsulfanylacetic acid.
Chemical Property Profile of Thioacetylthioglycolic acid
Property Insights of Thioacetylthioglycolic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thioacetylthioglycolic acid. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Thioacetylthioglycolic acid. Following Lipinski's Rule of Five, Thioacetylthioglycolic acid has 1 hydrogen bond donor(s) and 4 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 Thioacetylthioglycolic acid?
The CAS number of Thioacetylthioglycolic acid is 21224-41-9.
What is the molecular formula of Thioacetylthioglycolic acid?
The molecular formula of Thioacetylthioglycolic acid is C4H6O2S2.
What is the molecular weight of Thioacetylthioglycolic acid?
The molecular weight of Thioacetylthioglycolic acid is 149.98 g/mol.
Where can I buy Thioacetylthioglycolic acid?
You can request a quote for Thioacetylthioglycolic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioacetylthioglycolic acid?
Yes, KEHONG BIO provides custom synthesis services for Thioacetylthioglycolic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.