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1,2,4-Benzenetriol

CAS# 533-73-3

1,2,4-Benzenetriol

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1,2,4-Benzenetriol: 5mg Please Inquire In Stock
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Quality Control of 1,2,4-Benzenetriol

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Chemical structure

1,2,4-Benzenetriol

3D structure

Chemical Properties of 1,2,4-Benzenetriol

Cas No. 533-73-3 SDF Download SDF
PubChem ID 10787 Appearance Powder
Formula C6H6O3 M.Wt 126
Type of Compound N/A Storage Desiccate at -20°C
Solubility Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
Chemical Name benzene-1,2,4-triol
SMILES C1=CC(=C(C=C1O)O)O
Standard InChIKey GGNQRNBDZQJCCN-UHFFFAOYSA-N
Standard InChI InChI=1S/C6H6O3/c7-4-1-2-5(8)6(9)3-4/h1-3,7-9H
General tips For obtaining a higher solubility , please warm the tube at 37 ℃ and shake it in the ultrasonic bath for a while.Stock solution can be stored below -20℃ for several months.
We recommend that you prepare and use the solution on the same day. However, if the test schedule requires, the stock solutions can be prepared in advance, and the stock solution must be sealed and stored below -20℃. In general, the stock solution can be kept for several months.
Before use, we recommend that you leave the vial at room temperature for at least an hour before opening it.
About Packaging 1. The packaging of the product may be reversed during transportation, cause the high purity compounds to adhere to the neck or cap of the vial.Take the vail out of its packaging and shake gently until the compounds fall to the bottom of the vial.
2. For liquid products, please centrifuge at 500xg to gather the liquid to the bottom of the vial.
3. Try to avoid loss or contamination during the experiment.
Shipping Condition Packaging according to customer requirements(5mg, 10mg, 20mg and more). Ship via FedEx, DHL, UPS, EMS or other couriers with RT, or blue ice upon request.

1,2,4-Benzenetriol Dilution Calculator

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1,2,4-Benzenetriol Molarity Calculator

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Preparing Stock Solutions of 1,2,4-Benzenetriol

1 mg 5 mg 10 mg 20 mg 25 mg
1 mM 7.9365 mL 39.6825 mL 79.3651 mL 158.7302 mL 198.4127 mL
5 mM 1.5873 mL 7.9365 mL 15.873 mL 31.746 mL 39.6825 mL
10 mM 0.7937 mL 3.9683 mL 7.9365 mL 15.873 mL 19.8413 mL
50 mM 0.1587 mL 0.7937 mL 1.5873 mL 3.1746 mL 3.9683 mL
100 mM 0.0794 mL 0.3968 mL 0.7937 mL 1.5873 mL 1.9841 mL
* Note: If you are in the process of experiment, it's necessary to make the dilution ratios of the samples. The dilution data above is only for reference. Normally, it's can get a better solubility within lower of Concentrations.

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References on 1,2,4-Benzenetriol

Lewis Acid Catalyzed Conversion of 5-Hydroxymethylfurfural to 1,2,4-Benzenetriol, an Overlooked Biobased Compound.[Pubmed:29607267]

ACS Sustain Chem Eng. 2018 Mar 5;6(3):3419-3425.

5-Hydroxymethylfurfural (HMF) is a platform chemical that can be produced from renewable carbohydrate sources. HMF can be converted to 1,2,4-Benzenetriol (BTO) which after catalytic hydrodeoxygenation provides a route to cyclohexanone and cyclohexanol. This mixture, known as KA oil, is an important feedstock for polymeric products such as nylons which use benzene as feedstock that is obtained from the BTX fraction produced in oil refineries. Therefore, the conversion of HMF to BTO provides a renewable, alternative route toward products such as nylons. However, BTO is usually considered an undesired byproduct in HMF synthesis and is only obtained in small amounts. Here, we show that Lewis acid catalysts can be utilized for the selective conversion of HMF to BTO in subsuper critical water. Overall, up to 54 mol % yield of BTO was achieved at 89% HMF conversion using ZnCl2. ZnCl2 and similarly effective Zn(OTf)2 and Fe(OTf)2 are known as relatively soft Lewis acids. Other Lewis acid like Hf(OTf)4 and Sc(OTf)3 gave increased selectivity toward levulinic acid (up to 33 mol %) instead of BTO, a well-known HMF derivative typically obtained by acid catalysis. Catalytic hydrodeoxygenation of BTO toward cyclohexanone in water was achieved in up to 45% yield using 5 wt % Pd on Al2O3 combined with AlCl3 or Al(OTf)3 as catalysts. Additionally, a mild selective oxygen induced dimerization pathway of BTO to 2,2',4,4',5,5'-hexahydroxybiphenyl (5,5'-BTO dimer) was identified.

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