Propanedioic acid, [(4-methylphenyl)methyl]-, dimethyl ester

Base Information

Chemical Name:Propanedioic acid, [(4-methylphenyl)methyl]-, dimethyl ester
CAS No.:49769-82-6
Molecular Formula:C13H16O4
Molecular Weight:236.268
Hs Code.:
DSSTox Substance ID:DTXSID70446890
Nikkaji Number:J1.985.488D
Wikidata:Q82265633

Synonyms:49769-82-6;Propanedioic acid, [(4-methylphenyl)methyl]-, dimethyl ester;SCHEMBL16327191;DTXSID70446890;(4-Methylbenzyl)malonic acid dimethyl ester

Suppliers and Price of Propanedioic acid, [(4-methylphenyl)methyl]-, dimethyl ester

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 2 raw suppliers

Chemical Property of Propanedioic acid, [(4-methylphenyl)methyl]-, dimethyl ester

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:236.10485899
Heavy Atom Count:17
Complexity:251

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC=C(C=C1)CC(C(=O)OC)C(=O)OC

Technology Process of Propanedioic acid, [(4-methylphenyl)methyl]-, dimethyl ester

There total 7 articles about Propanedioic acid, [(4-methylphenyl)methyl]-, 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: 85.0%

: 589-18-4
4-Methylbenzyl alcohol

: 18424-76-5
sodiodimethylmalonate

: 49769-82-6
dimethyl 2-(4'-methylbenzyl)malonate

Guidance literature:: 4-Methylbenzyl alcohol; With trifluoromethylsulfonic anhydride; 1,1'-sulfinylbisbenzene; N,N,N',N'-tetramethyl-1,8-diaminonaphthalene; In toluene; at -78 ℃;

sodiodimethylmalonate; In tetrahydrofuran; toluene; at -78 - 20 ℃;
DOI:10.1246/cl.2004.8

Reference yield: 75.0%

: 59832-45-0
dimethyl 2-(4-methylbenzylidene)malonate

: 49769-82-6
dimethyl 2-(4'-methylbenzyl)malonate

Guidance literature:: With sodium tetrahydroborate; In methanol; acetonitrile; for 16h; Ambient temperature;
DOI:10.1021/ja00256a024

Reference yield: 68.0%

: 589-18-4
4-Methylbenzyl alcohol

: 108-59-8
malonic acid dimethyl ester

: 49769-82-6
dimethyl 2-(4'-methylbenzyl)malonate

Guidance literature:: With 1,3-bis-(diphenylphosphino)propane; palladium diacetate; caesium carbonate; carbonic acid dimethyl ester; at 120 ℃; for 15h; Inert atmosphere;
DOI:10.1039/c6gc00163g