Sodium 1-oxidopyridin-1-ium-2-thiolate
TL;DR: Sodium 1-oxidopyridin-1-ium-2-thiolate (CAS 3811-73-2) is a chemical compound with molecular formula C5H4NNaOS and molecular weight 148.99113 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium 1-oxidopyridin-1-ium-2-thiolate
Also Known As: Sodium Omadine, 2-Mercaptopyridine N-oxide sodium salt, Sodium 1-oxidopyridine-6-thiolate, sodium;1-oxidopyridin-1-ium-2-thiolate
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H4NNaOS |
| Molecular Weight | 148.99113 g/mol |
| XLogP | -2.77 |
| Topological Polar Surface Area (TPSA) | 26.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.99113 Da |
| Heavy Atoms | 9 |
| Complexity | 83.0 |
| SMILES | C1=CC=[N+](C(=C1)[S-])[O-].[Na+] |
| InChIKey | WNGMMIYXPIAYOB-UHFFFAOYSA-M |
Product Description
Applications: Sodium 1-oxidopyridin-1-ium-2-thiolate is used in analytical chemistry as a reagent, standard, or reference material, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as an oxidizing agent in synthetic sequences. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Sodium 1-oxidopyridin-1-ium-2-thiolate is a analytical reagent identified by CAS number 3811-73-2 and the molecular formula C5H4NNaOS and a molecular weight of 148.99 g/mol. Synonyms include Sodium Omadine and 2-Mercaptopyridine N-oxide sodium salt.
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 Sodium 1-oxidopyridin-1-ium-2-thiolate
Property Insights of Sodium 1-oxidopyridin-1-ium-2-thiolate
The XLogP value of -2.77 indicates that Sodium 1-oxidopyridin-1-ium-2-thiolate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.5 Ų, Sodium 1-oxidopyridin-1-ium-2-thiolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sodium 1-oxidopyridin-1-ium-2-thiolate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Sodium 1-oxidopyridin-1-ium-2-thiolate?
The CAS number of Sodium 1-oxidopyridin-1-ium-2-thiolate is 3811-73-2.
What is the molecular formula of Sodium 1-oxidopyridin-1-ium-2-thiolate?
The molecular formula of Sodium 1-oxidopyridin-1-ium-2-thiolate is C5H4NNaOS.
What is the molecular weight of Sodium 1-oxidopyridin-1-ium-2-thiolate?
The molecular weight of Sodium 1-oxidopyridin-1-ium-2-thiolate is 148.99113 g/mol.
What are the applications of Sodium 1-oxidopyridin-1-ium-2-thiolate?
Sodium 1-oxidopyridin-1-ium-2-thiolate is used in analytical chemistry as a reagent, standard, or reference material, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as an oxidizing agent in synthetic sequences. Available from CoreyChem...
Where can I buy Sodium 1-oxidopyridin-1-ium-2-thiolate?
You can request a quote for Sodium 1-oxidopyridin-1-ium-2-thiolate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sodium 1-oxidopyridin-1-ium-2-thiolate?
Yes, CoreyChem provides custom synthesis services for Sodium 1-oxidopyridin-1-ium-2-thiolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.