CAS 4372-31-0

2,2-Di-2-propen-1-ylpropanedioic acid

Description:

2,2-Di-2-propen-1-ylpropanedioic acid, also known as diallyl malonate, is an organic compound characterized by its structure, which features two allyl groups attached to a malonate backbone. This compound is typically a colorless to pale yellow liquid with a distinctive odor. It is soluble in organic solvents but has limited solubility in water. The presence of the double bonds in the allyl groups makes it reactive, particularly in polymerization reactions, allowing it to serve as a monomer in the synthesis of various polymers and resins. Additionally, the malonate moiety contributes to its acidity, making it a dicarboxylic acid. Due to its reactivity and functional groups, 2,2-Di-2-propen-1-ylpropanedioic acid is utilized in organic synthesis and can be involved in various chemical reactions, including esterification and Michael additions. Safety precautions should be taken when handling this compound, as it may cause irritation to the skin and eyes.

Formula: C₉H₁₂O₄

InChI: InChI=1S/C9H12O4/c1-3-5-9(6-4-2,7(10)11)8(12)13/h3-4H,1-2,5-6H2,(H,10,11)(H,12,13)

InChI key: InChIKey=VSJZBUJCPNVRET-UHFFFAOYSA-N

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

Synonyms:

• 1,6-Heptadiene-4,4-dicarboxylic acid
• 2,2-Di-2-propen-1-ylpropanedioic acid
• 2,2-Diallylmalonic acid
• Diallylmalonic acid
• Malonic acid, diallyl-
• Malonicacid, diallyl- (7CI,8CI)
• Propanedioic acid, di-2-propenyl-
• Propanedioic acid, di-2-propenyl- (9CI)
• a,a-Diallylmalonic acid
• Propanedioic acid, 2,2-di-2-propen-1-yl-

Diallylmalonic Acid

Controlled Product

CAS: 4372-31-0

Applications Diallylmalonic Acid is an intermediate in the synthesis of metabolites of Valproic Acid (V094750) as anticonvulsant agents. It can also be used for the synthesis of Velbanamine.
References Zielinski, G. K., et al.: Org. Biomolec. Chem., 13, 2684 (2015):

Formula: C₉H₁₂O₄

Color and Shape: Neat

Molecular weight: 184.19

Ref: TR-D415970