CID 3819775

Base Information

• Chemical Name: CID 3819775
• CAS No.: 144-62-7
• Molecular Formula: C2H2O4
• Molecular Weight: 90.0355
• Hs Code.: 2917111000
• Mol file: 144-62-7.mol

Synonyms:

Chemical Property of CID 3819775

Chemical Property:

• Appearance/Colour: Odorless white solid
• Vapor Pressure: 2.51E-06mmHg at 25°C
• Melting Point: 189-191 °C
• Boiling Point: 365.099 °C at 760 mmHg
• PKA: 1.38±0.54(Predicted)
• Flash Point: 188.79 °C
• PSA: 74.60000
• Density: 1.772 g/cm³
• LogP: -0.84440
• Water Solubility.: 90 g/L (20℃)
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 89.99530854
• Heavy Atom Count: 6
• Complexity: 78

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn:Harmful
• Statements: R21/22:
• Safety Statements: S24/25:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(=O)(C(=O)[O-])[OH2+]
• Chemical Properties: Oxalic acid, an alpha,omega-dicarboxylic acid, is the simplest of the dicarboxylic acids and has been known since its discovery by Scheele in 1734. It serves as a potential sustainable platform chemical with applications in various industries.
• Uses: The pharmaceutical industry is the largest consumer of oxalic acid, but it also finds use in agriculture, textiles, and leather industries. In the pharmaceutical sector, oxalic acid serves various purposes. Additionally, it is utilized as an acid rinse in laundries for removing rust and ink stains. Oxalic acid's leaching properties make it valuable in solubilizing heavy metals in materials like bauxite, clay, sewage sludge, and electronic waste. Its natural presence in many vegetable food products allows for its use as a natural anti-browning and preservation agent in fruit and vegetable storage.
• Role in Organic Chemistry: Oxalic acid serves as a precursor for glyoxylic acid, an important C2 building block for various organic molecules used in industries such as agrochemicals, aromas, cosmetic ingredients, pharmaceutical intermediates, and polymers.
• Biological Interactions and Environmental Impact: Oxalic acid plays a significant role in activating the uptake of perfluorooctanoic acid (PFOA) in soils, particularly through root exudates. It inhibits PFOA sorption to soils and enhances the dissolution of metallic ions and organic matter from soils, forming oxalate-metal complexes. These findings shed light on the mechanisms of PFOA activation in soils and provide insights into enhancing PFOA accumulation in lettuce varieties through oxalic acid at rhizospheric concentrations.
• Production Methods: The oldest route for oxalic acid production, discovered by Bergmann in 1776, involves the oxidation of biomass, particularly carbohydrates, using nitric acid. However, concerns about competition with food production and reliance on fossil fuels have prompted exploration into alternative production methods. Currently, oxalic acid is predominantly produced from fossil naphtha via propylene and ethylene glycol or CO obtained from coal.

Technology Process of CID 3819775

There total 2193 articles about CID 3819775 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

2-Amino-5-methylbenzenesulfonic acid (88-44-8) → 2,6-dinitro-p-cresol (609-93-8) + oxalic acid (144-62-7,97993-78-7)

Guidance literature:

Reference yield:

ethyl N-(4-nitrophenyl)oxamate (5416-11-5) + furan-2,3,5(4H)-trione pyridine (1:1) → ethanol (64-17-5) + oxalic acid (144-62-7,97993-78-7) + 4-nitro-aniline (100-01-6,104810-17-5)

Guidance literature:

Reference yield:

(2E)-but-2-enedioic acid (110-17-8,26099-09-2) → DL-tartaric acid (133-37-9,138508-61-9) + oxalic acid (144-62-7,97993-78-7)

Guidance literature:

With osmium(VIII) oxide; dihydrogen peroxide; tert-butyl alcohol; at 0 ℃;

DOI:10.1021/ja01298a065

upstream raw materials:

methanol

tetrachloromethane

1,1-bis(3,4-dimethylphenyl)ethylene

3,4-di-tert-butyl-1,1,6,6-tetraphenyl-hexa-1,2,4,5-tetraene

Downstream raw materials:

Dimethyl oxalate

2.3.5-trimethyl-6-((7R:11R)-trans-phytyl)-hydroquinone

O-Methyl-11,12-didehydro-retinol

2-(4-nitrophenyl)isoindoline-1,3-dione

Refernces

• 1、 Speakman,Waters. "-". . p. 40. Retrieved 1955.
• 2、 Balaban. "-". . p. 268,271. Retrieved 1930.
• 3、 Shailaja,Ramachandran. "Studies on the oxygen atom transfer reactions of peroxomonosulfate: Oxidation of glycolic acid". . p. 160 - 167. Retrieved 2009.
• 4、 Stefan, Mihaela I.,Hoy, Aitken R.,Bolton, James R.. "Kinetics and mechanism of the degradation and mineralization of acetone in dilute aqueous solution sensitized by the UV photolysis of hydrogen peroxide". . p. 2382 - 2390. Retrieved 1996.
• 5、 Hermans, Sophie,Deffernez, Aurore,Devillers, Michel. "Au-Pd/C catalysts for glyoxal and glucose selective oxidations". . p. 19 - 27. Retrieved 2011.
• 6、 Wendlandt, W. W.,Hoiberg, J. A.. "". . p. 506 - 511. Retrieved 1963.
• 7、 Quispe, Cristina,Nachtigall, Fabiane M.,Fonseca, Maria Francesca R.,Alberici, Rosana M.,Astudillo, Luis,Villasen?or, Jorge,Eberlin, Marcos N.,Santos, Leonardo S.. "Monitoring of β-blockers ozone degradation via electrospray ionization mass spectrometry". . p. 919 - 928. Retrieved 2011.
• 8、 Matsumoto, Takeshi,Sadakiyo, Masaaki,Ooi, Mei Lee,Yamamoto, Tomokazu,Matsumura, Syo,Kato, Kenichi,Takeguchi, Tatsuya,Ozawa, Nobuki,Kubo, Momoji,Yamauchi, Miho. "Atomically mixed Fe-group nanoalloys: Catalyst design for the selective electrooxidation of ethylene glycol to oxalic acid". . p. 11359 - 11366. Retrieved 2015.
• 9、 Nelson. "". . p. 572. Retrieved 1925.
• 10、 Seip, John E.,Fager, Susan K.,Gavagan, John E.,Gosser, Lawrence W.,Anton, David L.,DiCosimo, Robert. "Biocatalytic Production of Glyoxylic Acid". . p. 2253 - 2259. Retrieved 1993.