CAS 759-65-9

1,4-Diethyl 2-methyl-3-oxobutanedioate

Description:

1,4-Diethyl 2-methyl-3-oxobutanedioate, with the CAS number 759-65-9, is an organic compound that belongs to the class of diesters. It features a butanedioate backbone with ethyl groups attached to the first and fourth carbon atoms, and a methyl group on the second carbon, along with a ketone functional group at the third position. This compound is typically a colorless to pale yellow liquid with a fruity odor, indicative of its ester nature. It is soluble in organic solvents and exhibits moderate stability under standard conditions. The presence of multiple functional groups allows for various chemical reactivity, making it useful in organic synthesis and as an intermediate in the production of pharmaceuticals and agrochemicals. Additionally, its structure suggests potential applications in the development of flavoring agents or fragrances. Safety data should be consulted for handling and storage, as with many organic compounds, to ensure proper precautions are taken due to potential toxicity or reactivity.

Formula: C₉H₁₄O₅

InChI: InChI=1S/C9H14O5/c1-4-13-8(11)6(3)7(10)9(12)14-5-2/h6H,4-5H2,1-3H3

InChI key: InChIKey=OQOCQBJWOCRPQY-UHFFFAOYSA-N

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

Synonyms:

• 1,4-Diethyl 2-methyl-3-oxobutanedioate
• 2-Methyl-3-(oxo)succinic acid diethyl ester
• Ai3-05834
• Butanedioic acid, 2-methyl-3-oxo-, 1,4-diethyl ester
• Butanedioic acid, methyloxo-, diethyl ester
• Diethyl 2-Methyl-3-Oxobutanedioate
• Diethyl 2-methyl-3-oxo-1,4-butanedioate
• Diethyl 2-methyl-3-oxosuccinate
• Diethyl 2-oxo-3-methylsuccinate
• Diethyl 3-methyl-2-oxosuccinate
• Diethyl methyloxalacetate
• Diethyl methyloxobutanedioate
• Diethyl oxalopropionate
• Ethyl alpha-ethoxalylpropionate
• Ethyl α-ethoxalylpropionate
• Nsc 33946
• Oxalacetic acid, methyl-, diethyl ester
• Oxalacetic acid, methyl-, diethyl ester (8CI)
• Propanoic acid, 2-(ethoxyoxoacetyl)-, ethyl ester

Diethyl 2-methyl-3-oxosuccinate

CAS: 759-65-9

Formula: C₉H₁₄O₅

Purity: 95%

Color and Shape: Liquid

Molecular weight: 202.2045

Ref: IN-DA0036NK

Diethyl 2-methyl-3-oxosuccinate

CAS: 759-65-9

Diethyl 2-methyl-3-oxosuccinate

Purity: 95%

Color and Shape: Liquid

Molecular weight: 202.20g/mol

Ref: 54-OR40467

Diethyl oxalpropionate

CAS: 759-65-9

Diethyl oxalpropionate

Purity: ≥95%

Molecular weight: 202.2g/mol

Ref: 54-BUP19046

Diethyl Methyloxalacetate

CAS: 759-65-9

Formula: C₉H₁₄O₅

Purity: >96.0%(GC)

Color and Shape: Colorless to Orange to Green clear liquid

Molecular weight: 202.21

Ref: 3B-M0381

Diethyl oxalpropionate

CAS: 759-65-9

Diethyl oxalpropionate, a slightly soluble beta-keto acid derivative, is weakly acidic, mainly found in the cytoplasm.

Formula: C₉H₁₄O₅

Purity: 97.42%

Color and Shape: Solid

Molecular weight: 202.2

Ref: TM-T4768

Diethyl 2-methyl-3-oxosuccinate

CAS: 759-65-9

Formula: C₉H₁₄O₅

Purity: 95%

Color and Shape: Liquid

Molecular weight: 202.206

Ref: 10-F498996

Diethyl Oxalopropionate

Controlled Product

CAS: 759-65-9

Applications Diethyl Oxalopropionate is a useful precursor in the synthesis of 2-Methylcitric Acid (M265080); a metabolite of Citric Acid (C521000) that can also be formed from condensation of propionoyl-CoA and oxaloacetic acid catalyzed by a citrate synthase enzyme.
References Allen, R. H., et al.: Metabolism, 42, 978 (1993)

Formula: C₉H₁₄O₅

Color and Shape: Neat

Molecular weight: 202.2

Ref: TR-D444685

Diethyl Oxalopropionate-D3

Controlled Product

CAS: 759-65-9

Formula: C₉D₃H₁₁O₅

Color and Shape: Neat

Molecular weight: 205.223

Ref: TR-D444686

Diethyl oxalpropionate

CAS: 759-65-9

Diethyl oxalpropionate is a synthetic compound that has been used in biological studies. It is the sodium salt of diethyl oxalpropionate, which has a structural formula of C12H22O3. The synthesis of this compound is achieved through a transfer reaction involving oxetane and dodecanol. Diethyl oxalpropionate has been shown to inhibit chemokine production and insulin resistance in mice. It also interacts with hydroxyl groups on proteins, which may account for its ability to produce gels with different properties. Diethyl oxalpropionate can be identified by its spectrum on nmr or gel permeation chromatography. This chemical structure has two monomers: one is an alcohol (dodecanol) and the other is an ester (oxetane).

Formula: C₉H₁₄O₅

Purity: Min. 95%

Color and Shape: Clear Liquid

Molecular weight: 202.2 g/mol

Ref: 3D-FD52461