Tetraethyl propane-1,1,2,3-tetracarboxylate

Base Information

• Chemical Name: Tetraethyl propane-1,1,2,3-tetracarboxylate
• CAS No.: 635-03-0
• Molecular Formula: C15H24 O8
• Molecular Weight: 332.351
• Hs Code.: 2917190090
• European Community (EC) Number: 211-222-4
• NSC Number: 2198
• DSSTox Substance ID: DTXSID601034781
• Nikkaji Number: J205.907J
• Mol file: 635-03-0.mol

Synonyms:635-03-0;Tetraethyl propane-1,1,2,3-tetracarboxylate;1,1,2,3-Propanetetracarboxylic acid tetraethyl ester;1,1,2,3-Propanetetracarboxylic acid, tetraethyl ester;EINECS 211-222-4;Propane-1,1,2,3-tetracarboxylic Acid Tetraethyl Ester;1,1,2,3-PROPANETETRACARBOXYLICACIDTETRAETHYLESTER;AI3-02652;Tetraethyl 1,1,2,3-propanetetracarboxylate;NSC2198;SCHEMBL5940396;DTXSID601034781;NSC 2198;NSC-2198;MFCD00027834;AKOS024336556;CS-0368302;FT-0632695;P0487;Tetraethyl=propane-1,1,2,3-tetracarboxylate;D91964;1,1,2,3-PROPANETETRACARBOXYLIC ACID TETRAETHYLESTER;1,2,3-PROPANETETRACARBOXYLIC ACID, TETRAETHYL ESTER

Chemical Property of Tetraethyl propane-1,1,2,3-tetracarboxylate

Chemical Property:

• Vapor Pressure: 2.35E-06mmHg at 25°C
• Refractive Index: 1.4380-1.4420
• Boiling Point: 392.1°C at 760 mmHg
• PKA: 11.42±0.59(Predicted)
• Flash Point: 168.7°C
• PSA: 105.20000
• Density: 1.142g/cm³
• LogP: 0.86130
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 14
• Exact Mass: 332.14711772
• Heavy Atom Count: 23
• Complexity: 400

Purity/Quality:

98%,99%, ^*data from raw suppliers

Tetraethyl Propane-1,1,2,3-tetracarboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC(C(C(=O)OCC)C(=O)OCC)C(=O)OCC
• Uses: 1,1,2,3-PROPANETETRACARBOXYLIC ACID TETRAETHYL ESTER can be used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical production process.

Technology Process of Tetraethyl propane-1,1,2,3-tetracarboxylate

There total 9 articles about Tetraethyl propane-1,1,2,3-tetracarboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

diethyl malonate (105-53-3) + Diethyl maleate (141-05-9) → propane-1,1,2,3-tetracarboxylic acid tetraethyl ester (635-03-0)

Guidance literature:

With potassium compound of acetaldehyde dipropylacetal; at 90 ℃;

Reference yield:

diethyl malonate (105-53-3) → propane-1,1,2,3-tetracarboxylic acid tetraethyl ester (635-03-0)

Guidance literature:

With ethanol; sodium ethanolate;

Reference yield:

ethanol (64-17-5) → propane-1,1,2,3-tetracarboxylic acid tetraethyl ester (635-03-0)

Guidance literature:

at 180 - 200 ℃;

upstream raw materials:

diethyl chlorosuccinate

diethyl malonate

Diethyl maleate

sodium diethylmalonate

Downstream raw materials:

tricarallylic acid

trans-3-benzylaminocarbonyl-4-benzylaminocarbonylmethyl-1-benzylpyrrolidine-2,5-dione

2,5-dibenzyl-1,3,4,6-tetraoxoperhydropyrrolo<3,4-c>pyridine

((3S,4R)-1-Benzyl-4-benzylcarbamoyl-2,5-dioxo-pyrrolidin-3-yl)-acetic acid ethyl ester