S-acetylmercaptosuccinic anhydride
TL;DR: S-acetylmercaptosuccinic anhydride (CAS 6953-60-2) is a chemical compound with molecular formula C6H6O4S and molecular weight 174.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2,5-dioxooxolan-3-yl) ethanethioate
Also Known As: S-Acetylmercaptosuccinic anhydride, 2-(Acetylthio)succinic anhydride, SAMSA, Acetylthiosuccinic anhydride, (Acetylthio)succinic anhydride
| Molecular Formula | C6H6O4S |
|---|---|
| Molecular Weight | 174.00 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 85.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.99867 |
| Heavy Atoms | 11 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 6953-60-2 |
|---|---|
| SMILES | CC(=O)SC1CC(=O)OC1=O |
| InChIKey | AHTFMWCHTGEJHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
S-acetylmercaptosuccinic anhydride (CAS 6953-60-2), with molecular formula C6H6O4S and molecular weight 174.00 g/mol. IUPAC: S-(2,5-dioxooxolan-3-yl) ethanethioate.
Chemical Property Profile of S-acetylmercaptosuccinic anhydride
Property Insights of S-acetylmercaptosuccinic anhydride
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-acetylmercaptosuccinic anhydride. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for S-acetylmercaptosuccinic anhydride. Following Lipinski's Rule of Five, S-acetylmercaptosuccinic anhydride has 0 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 S-acetylmercaptosuccinic anhydride?
The CAS number of S-acetylmercaptosuccinic anhydride is 6953-60-2.
What is the molecular formula of S-acetylmercaptosuccinic anhydride?
The molecular formula of S-acetylmercaptosuccinic anhydride is C6H6O4S.
What is the molecular weight of S-acetylmercaptosuccinic anhydride?
The molecular weight of S-acetylmercaptosuccinic anhydride is 174.00 g/mol.
Where can I buy S-acetylmercaptosuccinic anhydride?
You can request a quote for S-acetylmercaptosuccinic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-acetylmercaptosuccinic anhydride?
Yes, KEHONG BIO provides custom synthesis services for S-acetylmercaptosuccinic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.