CAS 105-50-0

Acetonedicarboxylic Acid Diethyl Ester

Description:

Acetonedicarboxylic Acid Diethyl Ester, also known as diethyl 3-oxoglutarate, is an organic compound characterized by its structure, which includes two ester functional groups and a ketone. It is a colorless to pale yellow liquid with a fruity odor, commonly used as a reagent in organic synthesis and as an intermediate in the production of various chemicals. The compound is soluble in organic solvents such as ethanol and ether but has limited solubility in water. Its molecular structure allows it to participate in various chemical reactions, including esterification and condensation reactions, making it valuable in the synthesis of pharmaceuticals and agrochemicals. Additionally, it exhibits moderate toxicity, necessitating careful handling and appropriate safety measures during use. The compound's reactivity and functional groups make it a versatile building block in synthetic organic chemistry, contributing to its importance in research and industrial applications.

Formula: C₉H₁₄O₅

InChI: InChI=1/C9H14O5/c1-4-13-8(11)7(6(3)10)9(12)14-5-2/h7H,4-5H2,1-3H3

InChI key: InChIKey=ZSANYRMTSBBUCA-UHFFFAOYSA-N

SMILES: C(CC(OCC)=O)(CC(OCC)=O)=O

Synonyms:

• 1,3-Acetonedicarboxylic Acid Diethyl Ester
• 1,3-Acetonedicarboxylicaciddiethylester Diethyl3-oxoglutarate
• 1,5-Diethyl 3-oxopentanedioate
• 3-Oxo-Pentanedioic Aci Diethyl Ester
• 3-Oxo-Pentanedioicacidiethyl Ester
• 3-Oxopentanedioic acid diethyl ester
• Acetone-1,3-dicarboxylic acid diethyl ester
• Diethyl 1,3-Acetonedicarboxylate；Diethyl 3-Oxoglutarate
• Diethyl 1,3-acetone dicarboxylate
• Diethyl 1,3-acetonedicarboxylate
• Diethyl 2-oxopropane-1,3-dicarboxylate
• Diethyl 3-ketoglutarate
• Diethyl 3-oxoglutarate
• Diethyl 3-oxopentanedioate
• Diethyl Acetylpropanedioate
• Diethyl acetone-1,3-dicarboxylate
• Diethyl acetonedicarboxylate
• Diethyl β-ketoglutarate
• Diethyl β-oxoglutarate
• Diethyl-1,3-Acetonedicarboxyalte
• Diethyl-3-oxo-pentanedionate
• Diethyl1,3-Acetonedicarboxylate
• Diethylacetone dicarboxylate
• Glutaric acid, 3-oxo-, diethyl ester
• Glutaric acid, β-oxo-, diethyl ester
• NSC 9013
• Pentanedioic acid, 3-oxo-, 1,5-diethyl ester
• Pentanedioic acid, 3-oxo-, diethyl ester
• β-Ketoglutaric acid diethyl ester
• 3-KETOGLUTARIC ACID DIETHYL ESTER
• ETHYL ACETONEDICARBOXYLATE
• ACETONEDICARBOXYLIC ACID DIETHYL ESTER
• Diethyl beta-oxoglutarate
• Butanoic acid, (ethoxycarbonyl)-3-oxo-, ethyl ester
• 3-oxo-pentanedioicacidiethylester
• 3-OXOGLUTARIC ACID DIETHYL ESTER
• Ethyl 3-oxoglutarate
• 3-OXO-PENTANEDIOIC ACID, DIETHY ESTER

Diethyl 1,3-Acetonedicarboxylate

CAS: 105-50-0

Formula: C₉H₁₄O₅

Purity: >95.0%(GC)

Color and Shape: Colorless to Light yellow clear liquid

Molecular weight: 202.21

Ref: 3B-A0055

Diethyl acetone-1,3-dicarboxylate, 96%

CAS: 105-50-0

Synthesis of 1-substituted 4-ethoxycarbonyl-5- (ethoxycarbonylmethyl) pyrazoles Diethyl acetone-1, 3-dicarboxylate reacts with N, N-dimethylforma- mide dimethyl acetal (DMFDMA) in ethanol at room temperature. Unexpected product dichotomy is produced in the Biginelli-like condensation of 2-hydroxyben

Formula: C₉H₁₄O₅

Purity: 96%

Color and Shape: Clear colorless, Liquid

Molecular weight: 202.21

Ref: 02-A10933

Diethyl 1,3-acetonedicarboxylate

CAS: 105-50-0

Formula: C₉H₁₄O₅

Purity: 95%

Color and Shape: Liquid

Molecular weight: 202.2045

Ref: IN-DA0034PX

Diethyl 1,3-acetonedicarboxylate

CAS: 105-50-0

Formula: C₉H₁₄O₅

Molecular weight: 202.21

Ref: 7W-GK7302

Diethyl 3-oxoglutarate

CAS: 105-50-0

Diethyl 3-oxoglutarate

Formula: C₉H₁₄O₅

Purity: 95%

Color and Shape: clear. colourless liquid

Molecular weight: 202.20g/mol

Ref: 54-OR11166

Diethyl 3-Oxopentanedioate

Controlled Product

CAS: 105-50-0

Applications Diethyl 3-Oxopentanedioate is a reactant used in the synthesis of 2-(3-benzoylthioureido)-thiophene-3-carbonitrile derivatives with antimicrobial activity.
References Prabhu, P.J., et. al.: Int. J. Chem., 3, 91 (2014)

Formula: C₉H₁₄O₅

Color and Shape: Neat

Molecular weight: 202.2

Ref: TR-D444595

Diethyl 3-oxopentanedioate

CAS: 105-50-0

Formula: C₉H₁₄O₅

Purity: 95%

Color and Shape: Liquid, Clear

Molecular weight: 202.206

Ref: 10-F238898

Bempedoic Acid Impurity 41

CAS: 105-50-0

Formula: C₉H₁₄O₅

Molecular weight: 202.21

Ref: ST-EA-CP-B42036

Diethyl 3-oxoglutarate

CAS: 105-50-0

Diethyl 3-oxoglutarate is a sodium salt of a diethyl ester of malonic acid. It has been shown to be cytotoxic in vitro and in vivo, but its mechanism of action is not well understood. Diethyl 3-oxoglutarate may be involved in the production of reactive oxygen species and the induction of DNA damage by alkylating DNA. The compound has also been shown to have anti-inflammatory properties, which may be due to its ability to inhibit the production of prostaglandins.

Formula: C₉H₁₄O₅

Purity: Min. 95%

Molecular weight: 202.2 g/mol

Ref: 3D-FD34333