5349-99-5

Basic information

• Product Name: TRIETHYL ACONITATE
• Synonyms: TRIETHYL ACONITATE;cis-propene-1,2,3-tricarboxylicacidtriethylester;cispropene-1,2,3-tricarboxylicacidtriethylester;triethyl 1-propene-1,2,3-tricarboxylate;1-Propene-1,2,3-tricarboxylic acid triethyl ester;Aconitic acid triethyl ester;(Z)-triethyl prop-1-ene-1,2,3-tricarboxylate
• CAS NO: 5349-99-5
• Molecular Formula: C₁₂H₁₈O₆
• Molecular Weight: 258.27
• EINECS: 226-318-1
• Mol File: 5349-99-5.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 324.3°Cat760mmHg
• Flash Point: 139°C
• Appearance: /
• Density: 1.12g/cm³
• Vapor Pressure: 0.000248mmHg at 25°C
• Refractive Index: 1.457
• CAS DataBase Reference: TRIETHYL ACONITATE(CAS DataBase Reference)
• NIST Chemistry Reference: TRIETHYL ACONITATE(5349-99-5)
• EPA Substance Registry System: TRIETHYL ACONITATE(5349-99-5)

Safety Data

• Hazardous Substances Data: 5349-99-5(Hazardous Substances Data)

Usage

Chemical Properties

Liquid.D1.096 (25C), refr index 1.4517 (26C), bp 154–156 (5 mm Hg). Combustible.

Uses

Plasticizer.

InChI:InChI=1/C12H18O6/c1-4-16-10(13)7-9(12(15)18-6-3)8-11(14)17-5-2/h7H,4-6,8H2,1-3H3/b9-7-

Upstream product

• 64-17-5 ethanol 
• 499-12-7 1 propene 1,2,3 tricarboxylic acid 
• 77-93-0 citric acid triethyl ester 
• 36016-13-4 diethyl 2-aminofumarate 
• 64-19-7 acetic acid 
• 623-73-4 diazoacetic acid ethyl ester 
• 77-89-4 triethyl O-acetylcitrate 

Relevant articles and documents

Facile synthesis of silylated 4,5-disubstituted phthalates via inverse electron-demand cycloaddition of 2-pyrone-4,5-dicarboxylate with silylacetylenes

A facile and efficient synthesis of silylated 4,5-disubstituted phthalates through the inverse electron-demand [4+2] cycloaddition of 2-pyrone-4,5-dicarboxylate with various silylacety-lenes has been developed. The reaction was promoted by 4A molecular sieves (MS 4A) to afford the corresponding polysubstituted arenes with functionalizable silyl groups in good to high yield, thus providing versatile access to a wide variety of functionalized phthalates that represent promising intermediates for the synthesis of fine chemicals, particularly photochemically active compounds.

Synthesis of 2-Oxo-2H-pyran-5-carboxylate Derivatives

3-Substituted diethyl pent-2-enedioates are easily formylated by means of ethyl formate/TiCl4/4-methylmorpholine to produce the ethoxymethylene derivatives, which are smoothly cyclized either with HCOOH or PPA to the corresponding 2-oxo-2H-pyran-5-carboxylate derivatives.