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Trimethylpyruvic acid

Trimethylpyruvic acid

CAS: 815-17-8

Molecular Formula: C6H10O3

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Trimethylpyruvic acid - Names and Identifiers

Name Trimethylpyruvic acid
Synonyms TMPA
RARECHEM AL BO 2323
TRIMETHYLPYRUVIC ACID
Trimethylpyruvic acid
3,3-dimethyl-2-oxo-butyricaci
3,3-dimethyl-2-oxobutyricacid
3,3-dimethyl-2-oxo-butanoicaci
3,3-Dimethyl-2-oxobutyric acid
3,3-dimethyl-2-oxo-butyric acid
3,3-dimethyl-2-oxobutanoic acid
3,3-DIMETHYL-2-OXO-BUTANOIC ACID
Butyric acid, 3,3-dimethyl-2-oxo-
CAS 815-17-8
EINECS 212-418-2
InChI InChI=1/C6H10O3/c1-6(2,3)4(7)5(8)9/h1-3H3,(H,8,9)
InChIKey IAWVHZJZHDSEOC-UHFFFAOYSA-N

Trimethylpyruvic acid - Physico-chemical Properties

Molecular FormulaC6H10O3
Molar Mass130.14
Density1.06
Melting Point90.5°C
Boling Point80 °C / 15mmHg
Flash Point13 °C
Water SolubilitySoluble in water
Vapor Presure0.374mmHg at 25°C
AppearanceWhite to yellowish waxy solid or liquid
ColorWhite or Colorless to Almost white or Almost colorless
pKa2.65±0.54(Predicted)
Storage ConditionInert atmosphere,Room Temperature
Refractive Index1.4270-1.4320
Physical and Chemical PropertiesThis product is needle-like crystal, m. P. 125 ℃, difficult to dissolve in ether and chloroform, the sodium salt is long Flake, soluble in water.

Trimethylpyruvic acid - Risk and Safety

Hazard SymbolsC - Corrosive
Corrosive
Risk CodesR36/37/38 - Irritating to eyes, respiratory system and skin.
R34 - Causes burns
Safety DescriptionS26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39 - Wear suitable gloves and eye/face protection
S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection.
UN IDs3261
TSCAYes
Hazard Class8
Packing GroupIII

Trimethylpyruvic acid - Reference Information

NIST chemical information information provided by: webbook.nist.gov (external link)
EPA chemical substance information information provided by: ofmpeb.epa.gov (external link)
Application trimethylpyruvic acid is an organic synthesis intermediate and pharmaceutical intermediate, which can be used in laboratory research and development of synthetic process and chemical biological research and development process.
preparation method a synthesis process of trimethylpyruvic acid, comprising 1) Adding 250-350kg of dichloroefanone and 250-350kg of water to a reaction kettle, stir to 50? After 80 ℃, keep the temperature, add 800-1000kg of liquid alkali with concentration of 30% Dropwise within 5H, continue the reaction for 3h after adding, obtain aqueous solution containing intermediate; 2) add 200-300kg of potassium permanganate to the aqueous solution containing intermediate, during the period of 50? 60 ℃,5H added, continue the reaction for 3H, filter, collect the filtrate, adjust the filtrate pH = 1, extract the filtrate with 500kg dichloromethane to obtain the organic layer, the organic layer was distilled to 100 ℃ under atmospheric pressure, the temperature was cooled to 40 ° C., and 280-320kg of petroleum ether was slowly added, and the reaction was stirred at 5-10 ° C. For 5h, and centrifuged to obtain the product.
Use 3, 3-dimethylbutanoic acid is an intermediate of the herbicide profezin.
production method the preparation method is to add dichlorocyclocyanone into the reaction kettle, and then add water and a certain amount of alkali solution, heating hydrolysis under dilute alkali aqueous solution to produce sodium 3, 3-dimethyl-2-hydroxybutyrate, and then adding sodium hypochlorite solution Dropwise, oxidizing at low temperature and in the presence of catalyst, the 2-hydroxy group is oxidized to 2-oxygen, and after the oxidation is completed, the catalyst is filtered off, and the resulting filtrate, sodium 3, 3-dimethylbutanone, is further acidified to obtain a finished product.
toxic substance data information provided by: pubchem.ncbi.nlm.nih.gov (external link)
Last Update:2024-04-10 22:29:15
Trimethylpyruvic acid
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