79918-80-2

Basic information

• Product Name: (Z)-5-methyl-hex-2-enoic acid ethyl ester
• Synonyms: (Z)-5-methyl-hex-2-enoic acid ethyl ester
• CAS NO: 79918-80-2
• Molecular Weight: 156.225
• Mol File: 79918-80-2.mol
• Article Data: 15

Chemical Properties

• CAS DataBase Reference: (Z)-5-methyl-hex-2-enoic acid ethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: (Z)-5-methyl-hex-2-enoic acid ethyl ester(79918-80-2)
• EPA Substance Registry System: (Z)-5-methyl-hex-2-enoic acid ethyl ester(79918-80-2)

Safety Data

• Hazardous Substances Data: 79918-80-2(Hazardous Substances Data)

Upstream product

• 64-17-5 ethanol 
• 41653-96-7 5-methyl-2-hexenoic acid 
• 51615-30-6 diethyl 2-(3-methylbutylidene)malonate 
• 105-53-3 diethyl malonate 
• 590-86-3 isovaleraldehyde 
• 1071-46-1 hydrogen ethyl malonate 
• 141-78-6 ethyl acetate 
• 867-13-0 diethoxyphosphoryl-acetic acid ethyl ester 

Downstream Products

• 181289-39-4 (S)-3-cyano-5-methylhexanoic acid ethyl ester 
• 181289-23-6 (S)-4-isobutyl-pyrrolidin-2-one 
• 1039768-38-1 (R)-3-(dimethylphenylsilyl)-5-methylhexanoic acid ethyl ester 
• 261896-39-3 cis-4-(S)-isobutylpyrrolidine-3-(R)-carboxylic acid 
• 261896-48-4 1-benzyl-4-(S)-isobutylpyrrolidine-3-(S)-carboxylic acid 
• 261896-47-3 1-benzyl-4-(S)-isobutyl-3-(S)-[4'-(R)-phenyl-2'-oxazolidinon-3'-yl]carbonyl pyrrolidine 
• 148553-50-8 pregabilin 
• 1361023-96-2 C₁₄H₁₉N 
• 1310495-06-7 ethyl 3-[2,2-dimethyl-4,6-dioxo-3-[(1S)-1-phenylethyl]-1,3-oxazinan-5-yl]-5-methyl-hexanoate 
• 1310495-02-3 (S)-ethyl 5-methyl-3-[2-oxo-2-((S)-1-phenylethylamino)ethyl] hexanoate 
• 1310495-04-5 (S)-3-(aminomethyl)-5-methyl-N-((S)-1-phenylethyl)hexanamide 
• 1310495-03-4 (S)-3-(2-hydrazinyl-2-oxoethyl)-5-methyl-N-((S)-1-phenylethyl) hexanamide 

Relevant articles and documents

A practical, efficient, and atom economic alternative to the Wittig and Horner-Wadsworth-Emmons reactions for the synthesis of (E)-α,β- unsaturated esters from aldehydes

We describe a highly efficient new methodology for the synthesis of (E)-α,β-unsaturated esters from aldehydes. In our DMAP-catalyzed reaction, both aromatic as well as aliphatic aldehydes furnish the desired products highly regio- and stereoselectively if treated with commercially available or synthetically easily accessible malonic acid half ester. A large scale application in the synthesis of p-methoxycinnamates, which are of use as sunscreen ingredients, is described.

Method for preparing pregabalin by photocatalysis (by machine translation)

The preparation method is characterized by comprising the 3S following -3 - steps:5 - 1) dissolving the compound I and a certain amount of alkali in an organic solvent, adding the compound II, heating the reaction, obtaining the compound III, 2) preparing the compound V; 3) preparing the compound V through deprotection, ring opening, chiral resolution, and recrystallization to obtain pregabalin. The preparation method comprises the following steps: 1) dissolving compound III, compound IV and photocatalyst in an organic solvent. The raw materials used in the invention are cheap and easily available, the reaction conditions of the photocatalytic oxidation method are mild, reagents are environmentally friendly, green and environment-friendly, and the method is an ideal industrial production process. (by machine translation)

Method for preparing 3-isobutylglutaric acid

The invention discloses a method for preparing 3-isobutylglutaric acid. The method includes the following steps: carrying out a Knoevenagel condensation reaction on isovaleraldehyde and diethyl malonate with hexahydropyridine acetate as a catalyst in a cyclohexane solvent; carrying out a heating decarboxylation reaction on a product obtained by the first step in a solution composed of sodium chloride, DMSO and water; carrying out a Michael addition and decarboxylation reaction on a product obtained by the second step and diethyl malonate in an alcohol solvent of an alkali; and carrying out a hydrolysis reaction on a product obtained by the third step under an acidic condition to obtain the 3-isobutylglutaric acid product. The method of the invention uses the cheap and easily available isovaleraldehyde and diethyl malonate as raw materials, overcomes the defect of large steric hindrance of carbon-carbon a double bond in 5-methyl-2-cyano-2-hexenoate in the prior art, shortens the reaction time, and increases the reaction conversion rate of the isovaleraldehyde, thereby ensuring the overall yield of the 3-isobutylglutaric acid product.