vitamin B1
TL;DR: vitamin B1 (CAS 59-43-8) is a chemical compound with molecular formula C12H17ClN4OS and molecular weight 300.08115 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol chloride
Also Known As: vitamin B1, thiamine, thiamin, Thiamine chloride, Thiamine monochloride
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H17ClN4OS |
| Molecular Weight | 300.08115 g/mol |
| XLogP | -2.39 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.08115 Da |
| Heavy Atoms | 19 |
| Complexity | 268.0 |
| SMILES | CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[Cl-] |
| InChIKey | MYVIATVLJGTBFV-UHFFFAOYSA-M |
Product Description
Applications: vitamin B1 is used in biotechnology workflows and life-science research, 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).
vitamin B1 is a biotechnology compound identified by CAS number 59-43-8 and the molecular formula C12H17ClN4OS and a molecular weight of 300.08 g/mol. Synonyms include vitamin B1 and thiamine.
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 vitamin B1
Property Insights of vitamin B1
The XLogP value of -2.39 indicates that vitamin B1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for vitamin B1. Following Lipinski's Rule of Five, vitamin B1 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of vitamin B1?
The CAS number of vitamin B1 is 59-43-8.
What is the molecular formula of vitamin B1?
The molecular formula of vitamin B1 is C12H17ClN4OS.
What is the molecular weight of vitamin B1?
The molecular weight of vitamin B1 is 300.08115 g/mol.
What are the applications of vitamin B1?
vitamin B1 is used in biotechnology workflows and life-science research, 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...
Where can I buy vitamin B1?
You can request a quote for vitamin B1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for vitamin B1?
Yes, CoreyChem provides custom synthesis services for vitamin B1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.