Butanedioic acid, benzoyl-, dimethyl ester

Base Information

Chemical Name:Butanedioic acid, benzoyl-, dimethyl ester
CAS No.:85979-98-2
Molecular Formula:C13H14O5
Molecular Weight:250.251
Hs Code.:
DSSTox Substance ID:DTXSID60465499
Nikkaji Number:J2.024.253A

Synonyms:Butanedioic acid, benzoyl-, dimethyl ester;85979-98-2;DTXSID60465499

Suppliers and Price of Butanedioic acid, benzoyl-, dimethyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Butanedioic acid, benzoyl-, dimethyl ester

Chemical Property:

XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:250.08412354
Heavy Atom Count:18
Complexity:317

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CC(C(=O)C1=CC=CC=C1)C(=O)OC

Technology Process of Butanedioic acid, benzoyl-, dimethyl ester

There total 9 articles about Butanedioic acid, benzoyl-, dimethyl ester 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: 93.0%

: 67-56-1
methanol

: 1189-71-5
isocyanate de chlorosulfonyle

: 2051-95-8
succinylbenzene

: 85979-98-2
2-benzoyl-succinic acid dimethyl ester

Guidance literature:: isocyanate de chlorosulfonyle; succinylbenzene; With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 2h; Green chemistry;

methanol; In dichloromethane; at 20 ℃; for 1h; Green chemistry;
DOI:10.24820/ARK.5550190.P011.209

Reference yield: 85.0%

: 100-52-7
benzaldehyde

: 624-49-7
dimethylfumarate

: 85979-98-2
2-benzoyl-succinic acid dimethyl ester

Guidance literature:: With 3-(2,4,6-trimethyl-phenyl)-5,6,7,8-tetrahydro-4H-cycloheptathiazol-3-ium perchlorate; potassium carbonate; In tetrahydrofuran; at 50 ℃; for 5h; Inert atmosphere; Sealed tube;
DOI:10.1002/chem.202000747