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Thiamine Hydrochloride structure
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Thiamine Hydrochloride

TL;DR: Thiamine Hydrochloride (CAS 67-03-8) is a chemical compound with molecular formula C12H18Cl2N4OS and molecular weight 336.05783 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;hydrochloride

Also Known As: THIAMINE HYDROCHLORIDE, Thiamine HCL, Aneurine hydrochloride, Clotiamina, Eskaphen

CAS Number
67-03-8
Molecular Formula
C12H18Cl2N4OS
Molecular Weight
336.05783 g/mol
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Application Areas

Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (353 patents) Analytical Reagents (777 patents) Biotechnology (9969 patents) Catalysts (56 patents) Coatings & Adhesives (8 patents)

Technical Specifications

Molecular FormulaC12H18Cl2N4OS
Molecular Weight336.05783 g/mol
XLogP-1.97
Topological Polar Surface Area (TPSA)104.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass336.05783 Da
Heavy Atoms20
Complexity268.0
SolubilitySoluble in water, propylene glycol; Insoluble in ether, benzene, hexane, chloroform
SMILESCC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
InChIKeyDPJRMOMPQZCRJU-UHFFFAOYSA-M

Product Description

Applications: Thiamine Hydrochloride 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. CoreyChem supplies Thiamine Hydrochloride (CAS 67-03-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A biotechnology compound supplied by CoreyChem, Thiamine Hydrochloride (CAS 67-03-8) has the molecular formula C12H18Cl2N4OS and a molecular weight of 336.06 g/mol. Reported properties include a solubility: Soluble in water, propylene glycol; Insoluble in ether, benzene, hexane, chloroform. It is also known as THIAMINE HYDROCHLORIDE and Thiamine HCL.

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 Thiamine Hydrochloride

XLogP
-1.97
TPSA (Topological Polar Surface Area)
104.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
20
Complexity
268.0
Exact Mass
336.05783
Monoisotopic Mass
336.05783
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Thiamine Hydrochloride

The XLogP value of -1.97 indicates that Thiamine Hydrochloride 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 Thiamine Hydrochloride. Following Lipinski's Rule of Five, Thiamine Hydrochloride has 3 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 Thiamine Hydrochloride?

The CAS number of Thiamine Hydrochloride is 67-03-8.

What is the molecular formula of Thiamine Hydrochloride?

The molecular formula of Thiamine Hydrochloride is C12H18Cl2N4OS.

What is the molecular weight of Thiamine Hydrochloride?

The molecular weight of Thiamine Hydrochloride is 336.05783 g/mol.

What are the applications of Thiamine Hydrochloride?

Thiamine Hydrochloride 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. CoreyChem supplies Thiamine Hydrochloride (CAS 67-03-8) with custom...

Where can I buy Thiamine Hydrochloride?

You can request a quote for Thiamine Hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Thiamine Hydrochloride?

Yes, CoreyChem provides custom synthesis services for Thiamine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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