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Alpha-pyrone-4,6-dicarboxylic acid is a white crystalline solid with a molecular formula C7H6O6, belonging to the alpha-pyrone family of organic compounds. It features a six-membered ring with oxygen and double bonds, and is known for its slightly bitter taste.

72698-24-9

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72698-24-9 Usage

Uses

Used in Pharmaceutical Production:
Alpha-pyrone-4,6-dicarboxylic acid is used as an intermediate in the synthesis of various pharmaceuticals, contributing to the development of new drugs and medicines.
Used in Agrochemical Production:
alpha-pyrone-4,6-dicarboxylic acid is utilized as a building block in the creation of agrochemicals, playing a role in the development of pesticides and other agricultural products.
Used in Organic Synthesis:
Alpha-pyrone-4,6-dicarboxylic acid is employed as a key component in organic synthesis, enabling the production of a wide range of chemical compounds for various applications.
Used in Medicine:
Due to its unique molecular structure and properties, alpha-pyrone-4,6-dicarboxylic acid has potential applications in the medical field, potentially contributing to advancements in healthcare and treatment options.
Used in Materials Science:
alpha-pyrone-4,6-dicarboxylic acid's distinctive characteristics also make it a candidate for use in materials science, where it could be instrumental in the development of new materials with specific properties for various industries.

Check Digit Verification of cas no

The CAS Registry Mumber 72698-24-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,2,6,9 and 8 respectively; the second part has 2 digits, 2 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 72698-24:
(7*7)+(6*2)+(5*6)+(4*9)+(3*8)+(2*2)+(1*4)=159
159 % 10 = 9
So 72698-24-9 is a valid CAS Registry Number.
InChI:InChI=1/C7H4O6/c8-5-2-3(6(9)10)1-4(13-5)7(11)12/h1-2H,(H,9,10)(H,11,12)

72698-24-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 6-oxopyran-2,4-dicarboxylic acid

1.2 Other means of identification

Product number -
Other names 2-pyranone-4,6-dicarboxylic acid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:72698-24-9 SDS

72698-24-9Upstream product

72698-24-9Relevant academic research and scientific papers

Molecular properties of 2-pyrone-4,6-dicarboxylic acid (PDC) as a stable metabolic intermediate of lignin isolated by fractional precipitation with na+ Ion

Michinobu, Tsuyoshi,Bito, Masami,Yamada, Yoshiko,Katayama, Yoshihiro,Noguchi, Keiichi,Masai, Eiji,Nakamura, Masaya,Ohara, Seiji,Shigehara, Kiyotaka

, p. 2436 - 2442 (2007)

A chemically stable metabolic intermediate of lignin, 2-pyrone-4,6- dicarboxylic acid (PDC), was isolated, and the molecular properties were comprehensively investigated by using thermal analysis, optical spectroscopy, potentiometric titration, and X-ray crystallography. UV absorption spectra of PDC did not show any solvent effects, whereas the fluorescence spectra displayed distinct solvatochromism. Despite the fairly good planarity of the PDC geometry, dual fluorescence was observed in some small donor number solvents. The emission behaviors are thought to be due to the significant twist between the pyrone ring and carboxylate substituents, found in the X-ray crystal structures of the Na+ complex. The crystal structure also showed the intermolecular, centrosymmetric short hydrogen bonding of the carboxylate moieties with an O...H...O distance of 0.2452 nm, which made it possible to assign the pKa values to the molecular structure. PDC was thermally stable and could be sublimed even at atmospheric pressure, offering the preparation possibility of ultra-thin films by vapor-deposition techniques. The fact that the chemically and thermally stable compound possessing many attractive functions, such as unique emission, facile sublimation, and strong acidity, resulting in exceptionally short intermolecular contacts, can be obtained from biomass on a large quantity will lead to establishment of carbon neutral system in future industry.

LARGE-SCALE PURIFICATION OF 2-PYRONE-4,6-DICARBOXYLIC ACID

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Page/Page column 4, (2012/01/13)

To provide an industrial purification method of PDC obtained by fermentative production. A method of purifying 2-pyrone-4,6-dicarboxylic acid which comprises including a salt of monovalent to tetravalent cations in a fermentation liquid containing microbially-produced 2-pyrone-4,6-dicarboxylic acid; and a method of purifying 2-pyrone-4,6-dicarboxylic acid which method comprises extracting 2-pyrone-4,6-dicarboxylic acid from a fermentation liquid containing microbially-produced 2-pyrone-4,6-dicarboxylic acid without forming 2-pyrone-4,6-dicarboxylate.

Organogels of lignin-derived stable metabolic intermediate, 2-pyrone-4,6-dicarboxylic acid (PDC), Bearing cholesteryl groups

Michinobu, Tsuyoshi,Hiraki, Kenta,Fujii, Nozomu,Shikinaka, Kazuhiro,Katayama, Yoshihiro,Masai, Eiji,Nakamura, Masaya,Otsuka, Yuichiro,Ohara, Seiji,Shigehara, Kiyotaka

supporting information; experimental part, p. 400 - 401 (2010/07/10)

The organogelation behavior of a lignin-derived stable metabolic intermediate bearing two cholesteryl groups was examined for the first time, and it was found that the carbamate spacers possessing a hydrogen-bonding ability are essential for gelation of aliphatic or aromatic organic solvents.

A novel biomass-based polymer prepared from lignin-derived stable metabolic intermediate by copper(I)-catalyzed azide-alkyne click reaction

Michinobu, Tsuyoshi,Inazawa, Yasunori,Hiraki, Kenta,Katayama, Yoshihiro,Masai, Eiji,Nakamura, Masaya,Ohara, Seiji,Shigehara, Kiyotaka

, p. 154 - 155 (2008/09/18)

The CuI-catalyzed, but ligand-free azide-alkyne cycloaddition reaction was applied to the polymerization of the newly synthesized diethynyl-functionalized 2-pyrone monomer originally isolated from lignin via metabolic pathway. The polymerization was monitored by GPC and IR spectra and the resulting high molecular weight polymer was unambiguously characterized by 1H NMR, thermal analysis, and optical absorption and emission spectra. Copyright

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