CAS 2049-80-1

Diethyl allylmalonate

Description:

Diethyl allylmalonate is an organic compound characterized by its ester functional groups and a malonate backbone. It features two ethyl groups and an allyl group attached to the malonate structure, which contributes to its reactivity and versatility in organic synthesis. The compound typically appears as a colorless to pale yellow liquid with a fruity odor. It is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic ethyl groups. Diethyl allylmalonate is known for its use in various chemical reactions, including Michael additions and as a building block in the synthesis of more complex molecules, particularly in the pharmaceutical and agrochemical industries. Its reactivity is attributed to the presence of the allyl group, which can undergo various transformations, making it a valuable intermediate in organic synthesis. Safety precautions should be observed when handling this compound, as it may pose health risks if ingested or inhaled.

Formula: C₁₀H₁₆O₄

InChI: InChI=1S/C10H16O4/c1-4-7-8(9(11)13-5-2)10(12)14-6-3/h4,8H,1,5-7H2,2-3H3

InChI key: InChIKey=GDWAYKGILJJNBB-UHFFFAOYSA-N

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

Synonyms:

• (2-Propenyl)propanedioic acid diethyl ester
• 1,3-Diethyl 2-(prop-2-en-1-yl)propanedioate
• 2-Allylmalonic acid diethyl ester
• Allyldiethylmalonate
• Allylmalonic acid diethyl ester
• Diethyl 1-butene-4,4-dicarboxylate
• Diethyl 2-allyl-1,3-propanedioate
• Diethyl 2-allylmalonate
• Diethyl 2-prop-2-enylmalonate
• Diethyl 2-propenylmalonate
• Diethyl Prop-2-En-1-Ylpropanedioate
• Ethyl allylmalonate
• Malonic acid, allyl-, diethyl ester
• NSC 67393
• NSC 8777
• Propanedioic acid, 2-(2-propen-1-yl)-, 1,3-diethyl ester
• Propanedioic acid, 2-propenyl-, diethyl ester

Diethyl Allylmalonate

CAS: 2049-80-1

Formula: C₁₀H₁₆O₄

Purity: >98.0%(GC)

Color and Shape: Colorless to Almost colorless clear liquid

Molecular weight: 200.23

Ref: 3B-A0231

Diethyl allylmalonate, 96%

CAS: 2049-80-1

Diethyl allylmalonate is an important intermediates in syntheses of vitamins B1 and B6, barbiturates, non-steroidal anti-inflammatory agents, other numerous pharmaceuticals, agrochemicals and flavors and fragrances compounds. This Thermo Scientific Chemicals brand product was originally part of the

Formula: C₁₀H₁₆O₄

Purity: 96%

Color and Shape: Clear colorless to pale yellow, Liquid

Molecular weight: 200.23

Ref: 02-L02286

Propanedioic acid, 2-(2-propen-1-yl)-, 1,3-diethyl ester

CAS: 2049-80-1

Formula: C₁₀H₁₆O₄

Purity: 96%

Color and Shape: Liquid

Molecular weight: 200.2316

Ref: IN-DA0029QZ

Diethyl allylmalonate

CAS: 2049-80-1

Diethyl allylmalonate

Formula: C₁₀H₁₆O₄

Purity: 98%

Color and Shape: Liquid

Molecular weight: 200.234

Ref: 54-OR74771

Diethyl allylmalonate

CAS: 2049-80-1

Diethyl allylmalonate

Formula: C₁₀H₁₆O₄

Purity: 98% (stabilized with MEHQ)

Molecular weight: 200.23

Ref: IN-DG124646

Diethyl allylmalonate

CAS: 2049-80-1

Formula: C₁₀H₁₆O₄

Purity: 98% (stabilized with MEHQ)

Color and Shape: Liquid

Molecular weight: 200.234

Ref: 10-F102000

Diethyl Allylmalonate

Controlled Product

CAS: 2049-80-1

Applications Diethyl Allylmalonate is an important intermediate in the synthesis of vitamins B1 and B6, barbiturates, non-steroidal anti-inflammatory agents, other pharmaceuticals, agrochemicals and flavor/fragrance compounds.
References Trost, B.M., et al.: J. Am. Chem. Soc., 128, 8-9 (2006); Mori, M., et al.: Advanced Synthesis & Catalysis, 349, 121-135 (2007); J. Org. Chem., 61, 2266 (1996);

Formula: C₁₀H₁₆O₄

Color and Shape: Neat

Molecular weight: 200.23

Ref: TR-D443728