CAS 685-88-1

Propanedioic acid, 2-fluoro-, 1,3-diethyl ester

Description:

Propanedioic acid, 2-fluoro-, 1,3-diethyl ester, commonly known as diethyl 2-fluoromalonate, is an organic compound characterized by its diester functional groups derived from malonic acid. It features a fluorine atom at the second carbon position, which can influence its reactivity and properties. 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 the fluorine atom can enhance its electrophilic character, making it useful in various synthetic applications, particularly in the preparation of fluorinated compounds and pharmaceuticals. Additionally, diethyl 2-fluoromalonate can participate in nucleophilic substitution reactions and is often employed in the synthesis of more complex organic molecules. Safety data indicates that it should be handled with care, as it may pose health risks upon exposure. Overall, this compound is significant in organic synthesis and medicinal chemistry due to its unique structural features and reactivity.

Formula: C₇H₁₁FO₄

InChI: InChI=1S/C7H11FO4/c1-3-11-6(9)5(8)7(10)12-4-2/h5H,3-4H2,1-2H3

InChI key: InChIKey=GOWQBFVDZPZZFA-UHFFFAOYSA-N

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

Synonyms:

• 1,3-Diethyl 2-Fluoropropanedioate
• 2-Fluoro-malonic acid diethyl ester
• 2-Fluoro-malonic acid dimethyl(diethyl)ester
• 2-Fluoromalonic acid diethyl ester
• Diethyl 2-fluoromalonate
• Diethyl Fluoropropanedioate
• Ethyl fluoromalonate
• Fluoromalonic acid diethyl ester
• Fluoropropanedioic acid diethyl ester
• Malonic acid, fluoro-, diethyl ester
• NSC 521723
• Propanedioic acid, 2-fluoro-, 1,3-diethyl ester
• Propanedioic acid, fluoro-, diethyl ester
• Trifluoromethylsulfonyl 2,2,2-Trifluoroacetate

Diethyl fluoromalonate, 97%

CAS: 685-88-1

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₇H₁₁FO₄

Purity: 97%

Color and Shape: Clear colorless, Liquid

Molecular weight: 178.16

Ref: 02-B20766

Diethyl Fluoromalonate

CAS: 685-88-1

Formula: C₇H₁₁FO₄

Purity: 98%

Color and Shape: Liquid

Molecular weight: 178.1582

Ref: IN-DA0034QB

Diethyl 2-fluoromalonate

CAS: 685-88-1

Diethyl 2-fluoromalonate

Formula: C₇H₁₁FO₄

Purity: 97%

Color and Shape: clear. colourless liquid

Molecular weight: 178.16g/mol

Ref: 54-PC2564

Diethyl fluoromalonate

CAS: 685-88-1

Formula: FCH(CO₂CH₂CH₃)₂

Molecular weight: 178.16

Ref: 7W-GK0784

Diethyl Fluoromalonate

CAS: 685-88-1

Formula: C₇H₁₁FO₄

Purity: >95.0%(GC)

Color and Shape: Colorless to Almost colorless clear liquid

Molecular weight: 178.16

Ref: 3B-F0283

Diethyl fluoromalonate

CAS: 685-88-1

Formula: C₇H₁₁FO₄

Purity: 97%

Color and Shape: Clear light yellow liquid

Molecular weight: 178.159

Ref: 10-F003198

Diethyl fluoromalonate

CAS: 685-88-1

Diethyl fluoromalonate is a chemical that can be used to generate fluoroacetic acid. It has been shown to be an effective inhibitor of the growth of resistant mutants in vitro with magnetic resonance spectroscopy. The mechanism of action is not known, but it may involve the formation of a carbonyl group due to elimination of hydrogen fluoride. Diethyl fluoromalonate also reacts with malonic acid to form an aryl halide, which can then react with nitrogen atoms in cells and produce reactive oxygen species. This chemical has been shown to have anti-inflammatory effects in rats.

Formula: C₇H₁₁FO₄

Purity: Min. 95%

Molecular weight: 178.16 g/mol

Ref: 3D-FD15041