Oxythiamine
TL;DR: Oxythiamine (CAS 136-16-3) is a chemical compound with molecular formula C12H16N3O2S+ and molecular weight 266.0963 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-1H-pyrimidin-6-one
Also Known As: OXYTHIAMINE, Hydroxythiamine, Oxythiamin, hydroxythiamin, Oxythiamine chloride
Technical Specifications
| Molecular Formula | C12H16N3O2S+ |
| Molecular Weight | 266.0963 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.0963 Da |
| Heavy Atoms | 18 |
| Complexity | 395.0 |
| SMILES | CC1=C(SC=[N+]1CC2=CN=C(NC2=O)C)CCO |
| InChIKey | SRDGSXVLAVRBLU-UHFFFAOYSA-O |
Product Description
Applications: Oxythiamine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oxythiamine (CAS 136-16-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, Oxythiamine (CAS 136-16-3) has the molecular formula C12H16N3O2S+ and a molecular weight of 266.1 g/mol. It is also known as OXYTHIAMINE and Hydroxythiamine.
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 Oxythiamine
Property Insights of Oxythiamine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxythiamine. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxythiamine. Following Lipinski's Rule of Five, Oxythiamine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Oxythiamine?
The CAS number of Oxythiamine is 136-16-3.
What is the molecular formula of Oxythiamine?
The molecular formula of Oxythiamine is C12H16N3O2S+.
What is the molecular weight of Oxythiamine?
The molecular weight of Oxythiamine is 266.0963 g/mol.
What are the applications of Oxythiamine?
Oxythiamine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oxythiamine (CAS 136-16-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...
Where can I buy Oxythiamine?
You can request a quote for Oxythiamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Oxythiamine?
Yes, CoreyChem provides custom synthesis services for Oxythiamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.