Key facts
What buyers check first
- Appearance
- Crystals from water
- Melting point
- 164 °C
- Solubility
- MONONITRATE IS MUCH LESS SOL IN WATER THAN HYDROCHLORIDE
- HS code
- 293622
- Category
- Vitamins and nutraceutical actives

What is Thiamine?
Plain description, key identifiers and synonyms
Thiamine(1+) is a primary alcohol that is 1,3-thiazol-3-ium substituted by (4-amino-2-methylpyrimidin-5-yl)methyl, methyl and 2-hydroxyethyl groups at positions 3, 4 and 5, respectively. It has a role as a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a human metabolite. It is a primary alcohol and a vitamin B1. It is a conjugate base of a thiamine(2+).
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol
- CAS number
- 59-43-8 CAS number cross-checkedOther or deprecated CAS: 70-16-6
- EC number
- 200-425-3
- Molecular formula
- C12H17N4OS+
- UNII
- 4ABT0J945J
- InChIKey
- JZRWCGZRTZMZEH-UHFFFAOYSA-N
- InChI
- InChI=1S/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1
- SMILES (canonical and isomeric)
- CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO
Synonyms
- thiamin
- vitamin B1
- Aneurin
- Antiberiberi factor
- Betaxin
- thiaminium
- Bewon
- thiamine(1+) ion
- Betabion
- Thiaminal
- Trophite
- Vinothiam
- Lixa-beta
- Vetalin S
- 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium
- Vitamin B 1
- Oryzanine
- Thiamine, chloride
- B-Amin
- 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol
- 3-(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-5-(2-hydroxy-ethyl)-4-methyl-thiazol-3-ium
- Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl-chloride
- vitaminum b1
- vitamin-b1
- 2-(3-((4-amino-2-methylpyrimidin-5-yl)methyl)-4-methyl-1,3-thiazol-3-ium-5-yl)ethanol
Show all 38 synonymsShow fewer synonyms
- 3-((4-amino-2-methylpyrimidin-5-yl)methyl)-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium
- B1 Vitamin
- PureVita Vitamin B1
- Thiamine HCL 100 mg
- Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl-, chloride (1:1)
- 2-(3-((4-amino-2-methyl-pyrimidin-5-yl)methyl)-4-methyl-1-thia-3-azoniacyclopenta-2,4-dien-5-yl)ethanol
- 3-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methylthiazolium chloride
- Aneurine
- Apatate Drape
- Beivon
- Bethiamin
- Oryzanin
- Thiacoat
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
| Appearance | Crystals from waterexp.Measured value |
|---|---|
| Odour | SLIGHT, CHARACTERISTICexp.Measured value |
| Melting point | 164 °Cexp.Measured value |
| Solubility | MONONITRATE IS MUCH LESS SOL IN WATER THAN HYDROCHLORIDEexp.Measured value |
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 265.36 g/molcalc.Computed value |
|---|---|
| Exact mass | 265.1118 Dacalc.Computed value |
| LogP (octanol/water) | 0.61calc.Computed value |
| Topological polar surface area | 75.91 Ųcalc.Computed value |
| Hydrogen bond donors | 2calc.Computed value |
| Hydrogen bond acceptors | 5calc.Computed value |
| Rotatable bonds | 4calc.Computed value |
| Heavy atoms | 18calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 2calc.Computed value |
| Fraction sp3 carbons | 0.42calc.Computed value |
| Formal charge | 1calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidThiamine suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- United States, WayneUnclaimed profileVitamin B1Grade, purity and minimum order on requestPrice on request
- Price on request
- China ManufacturerUnclaimed profileVitamin B1Grade, purity and minimum order on requestPrice on request
- India, Palghar ManufacturerUnclaimed profileThiamineGrade, purity and minimum order on requestPrice on request
- China ManufacturerUnclaimed profileVitamin B1Grade, purity and minimum order on requestPrice on request
- China, HangzhouUnclaimed profileThiamineGrade, purity and minimum order on requestPrice on request
- China, Hangzhou ManufacturerUnclaimed profileThiamineGrade, purity and minimum order on requestPrice on request
- China ManufacturerUnclaimed profileThiamineGrade, purity and minimum order on requestPrice on request
- China, QingdaoUnclaimed profileThiamineGrade, purity and minimum order on requestPrice on request
- China, Hangzhou ManufacturerUnclaimed profileVitamin B1Grade, purity and minimum order on requestPrice on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
139 suppliers in 37 countries
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Thiamine price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Prevention and treatment of vitamin B1 deficiency.
Medicine, nutrition, enriched flours. Isolated usually as the chloride ... Available as thiamine hydrochloride and thiamine mononitrate.
Reported uses
Table: Reported uses (ppm): (Flavor and Extract Manufacturers' Association) [Table#841].
Therapeutic category: Vitamin (enzyme cofactor).
Industries and functions
Pharmacological actions
- Vitamin B Complex
Roles
- Escherichia coli metabolite
- Saccharomyces cerevisiae metabolite
- animal metabolite
- anti-anaemic agent
- bacterial metabolite
- cardiovascular drug
- eukaryotic metabolite
- fungal metabolite
- human metabolite
- immunomodulator
- immunosuppressive agent
- mammalian metabolite
- metabolite
- mouse metabolite
- pharmaceutical
- prokaryotic metabolite
- protective agent
- renoprotective agent
Functional uses
- Flavouring and nutrient
Pharmacology
Thiamine is a heat-labile and water-soluble essential vitamin, belonging to the vitamin B family, with antioxidant, erythropoietic, mood modulating, and glucose-regulating activities. Thiamine reacts with adenosine triphosphate (ATP) to form an active coenzyme, thiamine pyrophosphate. Thiamine pyrophosphate is necessary for the actions of pyruvate dehydrogenase and alpha-ketoglutarate in carbohydrate metabolism and for the actions of transketolase, an enzyme that plays an important role in the pentose phosphate pathway. Thiamine plays a key role in intracellular glucose metabolism and may inhibit the action of glucose and insulin on arterial smooth muscle cell proliferation. Thiamine may also protect against lead toxicity by inhibiting lead-induced lipid peroxidation.
How it is made
(A method for the chemical synthesis of thiamine) constructs the thiazole ring on a preformed pyrimidine intermediate. Thiamine manufacturers generally follow this approach. Some use malonitrile as the starting material for construction of the 4-amino-5-aminomethyl-2-methylpyrimidine ring (also called Grewe diamine).
Read more
Others start with acrylonitrile but all proceed via the key Grewe diamine intermediate through to thiothiamine.
/A method for the chemical synthesis of thiamine consists of separate syntheses of 4-amino-5-bromomethyl-2-methylpyrimidine hydrobromide and of the thiazole moiety or its acetate. Condensation of the two intermediate heterocycles gives thiamine bromide hydrobromide which is converted to thiamine chloride hydrochloride by treatment with silver chloride in methanol or with an ion-exchange resin.
Reaction of 5-(beta-hydroxyethyl)-4-methylthiazole with 2-methyl-4-amino-5-bromomethylpyrimidine, hydrogen bromide salt, followed by neutralization and reaction with hydrochloric acid
Regulatory status
Inventories, regulations and trade controls that list this substance
Health and food
- Active ingredient in FDA approved drug labels
United States
- TSCA inventory (USA)Status: Active in US commerce
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Thiamine is traded under.
Vitamin B1 and its derivatives
- China50.5%
- Netherlands19.4%
- Germany19.1%
- Netherlands28.6%
- United States13.2%
- India * partner reported5.7%
* Partner reported figures, a lower bound.
The HS code shown for Thiamine is indicative (it was matched by name in the HS nomenclature). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Thiamine, based on the data on this page
What is Thiamine?
What is the CAS number of Thiamine?
What is the molecular formula and weight of Thiamine?
What is Thiamine used for?
Is Thiamine hazardous?
What is the HS code of Thiamine?
Where can I buy Thiamine?
Where can I buy Thiamine in India?
What is the price of Thiamine?
Guides for buyers
Practical guides that help when you source, ship or handle Thiamine
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
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