Dibenzyl sebacate

Base Information

• Chemical Name: Dibenzyl sebacate
• CAS No.: 140-24-9
• Molecular Formula: C24H30 O4
• Molecular Weight: 382.5
• Hs Code.: 2917131000
• European Community (EC) Number: 205-404-2
• NSC Number: 3896
• UNII: WJA5SB9MSK
• DSSTox Substance ID: DTXSID2059691
• Nikkaji Number: J45.464H
• Wikidata: Q63392732
• Mol file: 140-24-9.mol

Synonyms:DIBENZYL SEBACATE;140-24-9;Sebacic Acid Dibenzyl Ester;dibenzyl decanedioate;Sebacic acid, dibenzyl ester;Decanedioic acid, bis(phenylmethyl) ester;Decanedioic acid, 1,10-bis(phenylmethyl) ester;WJA5SB9MSK;NSC 3896;NSC-3896;EINECS 205-404-2;AI3-02693;C24H30O4;1,10-dibenzyl decanedioate;UNII-WJA5SB9MSK;SCHEMBL118235;Decanedioic Acid Dibenzyl Ester;DTXSID2059691;Trans-Ferulic acidisopropyl ester;NSC3896;MFCD00039640;AS-66964;FT-0624657;D92237;Q63392732

Chemical Property of Dibenzyl sebacate

Chemical Property:

• Vapor Pressure: 1.77E-08mmHg at 25°C
• Melting Point: 27 °C
• Boiling Point: 455.3°Cat760mmHg
• Flash Point: 217°C
• PSA: 52.60000
• Density: 1.077g/cm³
• LogP: 5.59400
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 15
• Exact Mass: 382.21440943
• Heavy Atom Count: 28
• Complexity: 382

Purity/Quality:

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

Dibenzyl Sebacate >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)CCCCCCCCC(=O)OCC2=CC=CC=C2

Technology Process of Dibenzyl sebacate

There total 3 articles about Dibenzyl sebacate 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:

1,10-decanedioic acid (111-20-6,26776-29-4) + benzyl alcohol (100-51-6,185532-71-2) → dibenzyl ether (103-50-4) + decanedioic acid dibenzyl ester (140-24-9) + decanedioic acid monobenzyl ester (67852-88-4)

Guidance literature:

Microwave irradiation;

DOI:10.1134/S1070363208100162

Reference yield:

1,10-decanedioic acid (111-20-6,26776-29-4) + benzyl chloride (100-44-7) → decanedioic acid dibenzyl ester (140-24-9) + decanedioic acid monobenzyl ester (67852-88-4)

Guidance literature:

With potassium hydroxide; tetra(n-butyl)ammonium hydrogensulfate; In toluene; for 4.5h; Yield given; Heating;

DOI:10.1016/0040-4020(89)80151-6

Reference yield:

1,10-decanedioic acid (111-20-6,26776-29-4) + benzyl alcohol (100-51-6,185532-71-2) → decanedioic acid dibenzyl ester (140-24-9)

Guidance literature:

DOI:10.1021/ja01877a501

upstream raw materials:

1,10-decanedioic acid

benzyl alcohol

benzyl chloride

Refernces

• 1、 Aver'yanov,Batrakova,Samuilov,Spiridonova,Kochnev,Galibeev,Gnezdilov. "Esterification of dicarboxylic acids with benzyl alcohol under the action of the microwave radiation". experimental part. p. 1920 - 1923. Retrieved 2009/02/08.