1. chem960
  2. 59-43-8
Thiamine monochloride | 59-43-8

Product name:Thiamine monochloride

CAS No:59-43-8
MF:C12H17ClN4OS
MW:300.8076
MDL:MFCD00044586
CID:33729
PubChem ID:6042
Introduction
     Vitamin B1 (thiamine chloride) is a white needle shaped crystalline powder with a faint rice bran like special odor and bitter taste. It is suitable for vitamin B1 deficiency, has the function of maintaining normal glucose metabolism and nerve conduction, and is also used in the adjuvant treatment of dyspepsia \ neuritis, etc
Names and Identifiers
  • 3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-5-(2-hydroxyethyl)-4-methylthiazol-3-ium chloride
  • Metatone
  • Aneurin
  • Antiberiberi factor
  • Biamine
  • Betalin S
  • Betamin
  • Beta-Sol
  • Thiamine chloride
  • Vitamin B1
  • 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol,chloride
  • AURORA KA-7821
  • Thiamine (Vitamin B1)
  • 3-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-5-(2- hydroxyethyl)-4-methylthiazolium chloride
  • Betabion hydrochloride
  • thiamine hydrochloride
  • VitaMin B1 Hydrochloride
  • thiamine
  • Thiamine monochloride
  • Aneurine
  • Tiamina
  • Oryzanin
  • Thiaminum
  • Oryzanine
  • Bethiamin
  • Vitaneurin
  • Beivon
  • Apatate drape
  • Thiamine, chloride
  • B-Amin
  • Betabion
  • Thiamine [INN:BAN]
  • Tiamina [INN-Spanish]
  • Thiaminum [INN-Latin]
  • thiamine(1+) chloride
  • X66NSO3N35
  • AK109288
  • Thiamine (Vit B1)
  • Thiazolium, 3-((4-amino-2-me
  • thiamine(1+) ion
  • 3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM
  • SMR000875246
  • MLS001332448
  • MLS001332447
  • MLS001304099
  • Thiamine hydrochloride
  • MLSMR
  • SMR000718788
  • thiaminium
  • Thiamine
  • Thiamin
  • MDL:MFCD00044586
  • InChIKey:MYVIATVLJGTBFV-UHFFFAOYSA-M
  • Inchi:1S/C12H17N4OS.ClH/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);1H/q+1;/p-1
  • SMILES:[Cl-].S1C([H])=[N+](C([H])([H])C2=C([H])N=C(C([H])([H])[H])N=C2N([H])[H])C(C([H])([H])[H])=C1C([H])([H])C([H])([H])O[H]
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 300.08100
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Rotatable Bond Count: 4
  • Monoisotopic Mass: 300.081
  • Heavy Atom Count: 19
  • Complexity: 269
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 2
  • XLogP3: 1
  • Tautomer Count: 3
  • Surface Charge: 0
  • Topological Polar Surface Area: 104
  • Molecular Weight: 300.81

Experimental Properties

  • LogP: 1.99090
  • PSA: 104.15000
  • Refractive Index: 1.5630 (estimate)
  • Boiling Point: 351.9°C at 760 mmHg
  • Melting Point: 250-258°C
  • Vapor Pressure: 1.8X10-10 mm Hg at 25 °C (est)
  • Flash Point: °C
  • Solubility: SLIGHTLY SOL IN ALC & CHLOROFORM /MONONITRATE/
  • Color/Form: The white needle shaped crystalline powder has a faint special smell like rice bran and a bitter taste.
  • Solubility: It is very soluble in water (1g in 1ml20 ℃ water), slightly soluble in ethanol, and insoluble in ether, benzene, chloroform and acetone.
  • Density: 1.3175 (rough estimate)
  • Odor: SLIGHT, CHARACTERISTIC
Security Information
  • Safety Instruction:S26-S36/37/39-S22
  • Risk Phrases:R36/37/38-R20/21/22
  • Znak za nevarno blago: Xi Xi Xn Xn
  • Hazard Statement:H302-H315-H319-H335
  • Warning Statement:P261; P264; P271; P280; P302+P352; P304+P340; P305+P351+P338; P312; P321; P332+P313; P337+P313; P362; P403+P233; P405; P501
  • Storage Condition:Powder -20°C 3 years   4°C 2 years In solvent -80°C 6 months   -20°C 1 month
  • Signal Word:Warning
Customs Data
  • Customs Data:

    China Customs Code:

    3004500000
Synthetic Circuit

Synthetic Circuit 1

Reaction Conditions
1.1 Reagents: Sodium hydroxide ,  Iodine ,  Potassium iodide ,  Oxygen Solvents: Water
Reference
Oxidative activation of thiamine monophosphate hydrolysis
Babii, L. V.; Vovk, A. I., Fiziologichno Aktivni Rechovini, 2002, (1), 72-77
Related Products
Price Data Available
Brand:Mce Supplier:MedChemExpress
No. Purity Stock Specification Price update time operate
HY-A0100-10mM*1mLinWater 99.72% In-stock 10mM*1mLinWater ¥500 08 Jul. 2021
HY-A0100-500mg 99.88% In-stock 500mg ¥400 31 Aug. 2023
HY-A0100-1g 99.88% In-stock 1g ¥500 31 Aug. 2023
HY-A0100-10.110mm*1 ml in water 99.88% In-stock 10.110mm*1 ml in water ¥500 31 Aug. 2023
Brand:trc Supplier:TRC
No. Purity Stock Specification Price update time operate
A076595-500mg 0.0 500mg $87.00/ ¥631.90 18 May. 2023
A076595-1000mg 0.0 1g $ 150.00/ ¥1,089.48 07 May. 2021
A076595-2500mg 0.0 2500mg $ 300.00/ ¥2,178.96 07 May. 2021
A076595-5g 0.0 5g $98.00/ ¥711.79 18 May. 2023
A076595-1g 0.0 1g $92.00/ ¥668.21 18 May. 2023
Brand:dcchemical Supplier:DC Chemicals
No. Purity Stock Specification Price update time operate
DCZ-120-20mg >98% In stock 20mg $280.0/ ¥2,033.70 15 Sep. 2023
DCZ-120-20 mg >98% In stock 20mg $280.0/ ¥2,033.70 28 Feb. 2022
Brand:enovation Supplier:eNovation Chemicals LLC
No. Purity Stock Specification Price update time operate
D535901-100g 97% 100g $200/ ¥1,452.64 02 Sep. 2023
Brand:麦克林 Supplier:上海麦克林生化科技有限公司
No. Purity Stock Specification Price update time operate
A832636-2.5kg 98% 上海仓库:-/北方仓库:现货/南方仓库:- 2.5kg ¥5,464.00 03 Sep. 2022
A832636-500g 98% 上海仓库:现货/北方仓库:现货/南方仓库:- 500g ¥1,848.00 03 Sep. 2022
A832636-100g 98% 上海仓库:现货/北方仓库:现货/南方仓库:- 100g ¥618.00 03 Sep. 2022
A832636-25g 98% 上海仓库:现货/北方仓库:现货/南方仓库:- 25g ¥200.00 03 Sep. 2022
A832636-5g 98% 上海仓库:现货/北方仓库:现货/南方仓库:- 5g ¥98.00 03 Sep. 2022
A832636-1g 98% 上海仓库:现货/北方仓库:现货/南方仓库:- 1g ¥30.00 03 Sep. 2022
Brand:abcr Supplier:abcr
No. Purity Stock Specification Price update time operate
AB436632-100 g 95% 100g €208.50/ ¥1,511.88 18 Jul. 2023
AB436632-25 g 95% 25g €110.20/ ¥799.08 18 Jul. 2023
AB436632-5 g 95% 5g €77.40/ ¥561.24 18 Jul. 2023
AB436632-1kg 95% 1kg €891.00/ ¥6,460.82 04 Sep. 2023
AB436632-100g 95% 100g €208.50/ ¥1,511.88 04 Sep. 2023
AB436632-25g 95% 25g €110.20/ ¥799.08 04 Sep. 2023
AB436632-10g 95% 10g €87.80/ ¥636.66 04 Sep. 2023
AB436632-5g 95% 5g €77.40/ ¥561.24 04 Sep. 2023
AB436632-1 kg 95% 1kg €891.00/ ¥6,460.82 18 Jul. 2023
AB436632-10 g 95% 10g €87.80/ ¥636.66 18 Jul. 2023
Brand:chemenu Supplier:Chemenu
No. Purity Stock Specification Price update time operate
CM137746-500g 98% 3-4 Weeks 500g $385/ ¥2,796.33 17 Feb. 2023
CM137746-500g 98% 3-4 Weeks 500g $385/ ¥2,796.33 05 Aug. 2021
Brand:安捷凯 Supplier:武汉安捷凯生物医药科技有限公司
No. Purity Stock Specification Price update time operate
ajce44694-1g 98% 现货 1g ¥445.00 26 Apr. 2022
ajce46012-100mg 98% 现货 100mg ¥445.00 08 Sep. 2023
ajce46012-1g 98% 现货 1g ¥623.00 08 Sep. 2023
Brand:Acmec Supplier:上海吉至生化科技有限公司
No. Purity Stock Specification Price update time operate
T46130-25g 98% 现货 25g ¥188.0 29 Dec. 2022
T46130-100g 98% 7个工作日 100g ¥578.0 06 Sep. 2023
Brand:源叶 Supplier:上海源叶生物科技有限公司
No. Purity Stock Specification Price update time operate
S66713-25g 98% 上海:准现货/北京:0/武汉:0/南京:0 25g ¥580.00 02 Sep. 2021
S66713-5g 98% 上海:准现货/北京:0/武汉:0/南京:0 5g ¥200.00 02 Sep. 2021
Brand:selleck Supplier:Selleck中国
No. Purity Stock Specification Price update time operate
S4486-25mg 99.96% 现货 25mg ¥795.39 15 Sep. 2023
Brand:matrixscientific Supplier:Matrix Scientific
No. Purity Stock Specification Price update time operate
097639-10g 95+% Inquire 10g $300.00/ ¥2,178.96 06 Sep. 2023
097639-5g 95+% Inquire 5g $180.00/ ¥1,307.38 06 Sep. 2023
097639-1g 95+% Inquire 1g $75.00/ ¥544.74 06 Sep. 2023
Brand:九鼎 Supplier:上海贤鼎生物科技有限公司
No. Purity Stock Specification Price update time operate
MY9438-25g 98%+ 2.0 25g ¥204.0 10 Jun. 2022
MY9438-100g 98%+ 4.0 100g ¥663.0 10 Jun. 2022
Brand:enaminestore Supplier:Enamine
No. Purity Stock Specification Price update time operate
EN300-257540-5.0g Out of Stock 5.0g $40.0/ ¥290.53 28 Feb. 2023
EN300-257540-2.5g Out of Stock 2.5g $36.0/ ¥261.48 14 Sep. 2023
EN300-257540-1.0g Out of Stock 1g $0.0 07 Jun. 2023
EN300-257540-0.5g Out of Stock 0.5g $28.0/ ¥203.37 14 Sep. 2023
EN300-257540-0.25g Out of Stock 0.25g $27.0/ ¥196.11 14 Sep. 2023
EN300-257540-0.1g Out of Stock 0.1g $26.0/ ¥188.84 14 Sep. 2023
EN300-257540-0.05g Out of Stock 0.05g $25.0/ ¥181.58 14 Sep. 2023
EN300-257540-10.0g Out of Stock 10.0g $42.0/ ¥305.05 28 Feb. 2023
EN300-257540-10g Out of Stock 10g $42.0/ ¥305.05 14 Sep. 2023
EN300-257540-5g Out of Stock 5g $40.0/ ¥290.53 14 Sep. 2023
EN300-257540-1g Out of Stock 1g $29.0/ ¥210.63 14 Sep. 2023
Brand:ambeed Supplier:Ambeed
No. Purity Stock Specification Price update time operate
A117613-1kg 98% 中国:-/USA:- 1kg $570.0/ ¥4,140.02 17 Jun. 2023
A117613-500g 98% 中国:22/USA:1 500g $335.0/ ¥2,433.17 17 Jun. 2023
A117613-100g 98% 中国:5/USA:0 100g $98.0/ ¥711.79 17 Jun. 2023
A117613-25g 98% 中国:39/USA:5 25g $31.0/ ¥225.16 17 Jun. 2023
A117613-10g 98% 中国:26/USA:3 10g $16.0/ ¥116.21 17 Jun. 2023
A117613-5g 98% 中国:40/USA:7 5g $9.0/ ¥65.37 17 Jun. 2023
Brand:a2bchem Supplier:A2B Chem LLC
No. Purity Stock Specification Price update time operate
AI53192-500g 98% in stock 500g $235.00/ ¥1,706.85 30 Dec. 2023
AI53192-25g 98% in stock 25g $22.00/ ¥159.79 30 Dec. 2023
AI53192-10g 98% in stock 10g $12.00/ ¥87.16 30 Dec. 2023
AI53192-5g 98% in stock 5g $7.00/ ¥50.84 30 Dec. 2023
Brand:aaron Supplier:Aaron
No. Purity Stock Specification Price update time operate
AR00IB6C-100g 98% In China Stock 100g $89.00/ ¥646.42 13 Dec. 2023
AR00IB6C-25g 98% In China Stock 25g $29.00/ ¥210.63 13 Dec. 2023
AR00IB6C-10g 98% In China Stock 10g $17.00/ ¥123.47 13 Dec. 2023
AR00IB6C-5g 98% In China Stock 5g $10.00/ ¥72.63 13 Dec. 2023
AR00IB6C-1g 98% In China Stock 1g $5.00/ ¥36.32 13 Dec. 2023
AR00IB6C-1000g 98% In China Stock 1000g $508.00/ ¥3,689.71 13 Dec. 2023
AR00IB6C-500g 98% In China Stock 500g $299.00/ ¥2,171.70 13 Dec. 2023
Brand:targetmol Supplier:TargetMol Chemicals
No. Purity Stock Specification Price update time operate
T2O2741-1g 98% 上海现货 1g ¥ 423 15 Sep. 2023
T2O2741-500mg 98% 上海现货 500mg ¥ 338 15 Sep. 2023
T2O2741-100 mg 98% 现货(一周内发货) 100MG ¥ 362 10 Jul. 2023
Brand:scbt Supplier:圣克鲁斯生物技术
No. Purity Stock Specification Price update time operate
sc-338735-5g 5g ¥4505.00 05 Sep. 2023
sc-338735-5 g 5g ¥4,505.00 10 Jul. 2023
Brand:Key Organics Supplier:Key Organics Ltd
No. Purity Stock Specification Price update time operate
AS-15935-10MG >98% Usually 10 days 10mg £51.00/ ¥425.04 10 Jul. 2023
AS-15935-5MG >98% Usually 10 days 5mg £42.00/ ¥350.04 10 Jul. 2023
AS-15935-1MG >98% Usually 10 days 1mg £36.00/ ¥300.03 10 Jul. 2023
Brand:1pchem Supplier:1PlusChem
No. Purity Stock Specification Price update time operate
1P00IAY0-500g 98% In Stock USA 500g $268.00/ ¥1,946.54 16 Dec. 2023
1P00IAY0-25g 98% In Stock USA 25g $25.00/ ¥181.58 16 Dec. 2023
1P00IAY0-10g 98% In Stock USA 10g $13.00/ ¥94.42 16 Dec. 2023
1P00IAY0-5g 98% In Stock USA 5g $8.00/ ¥58.11 16 Dec. 2023
The above data is all sourced from the internet. If privacy is violated, please contact us as soon as possible (leave a copy of your company email), and we will take it down for processing! Sorry for any inconvenience caused!
©2008-2024 chem960.com All rights reserved