Dimethyl 3-(benzyloxy)pentanedioate

Base Information

Chemical Name:Dimethyl 3-(benzyloxy)pentanedioate
CAS No.:112904-65-1
Molecular Formula:C14H18O5
Molecular Weight:266.294
Hs Code.:
DSSTox Substance ID:DTXSID10553037
Nikkaji Number:J2.061.843D
Wikidata:Q82433515

Synonyms:112904-65-1;Dimethyl 3-(benzyloxy)pentanedioate;SCHEMBL20330054;DTXSID10553037;methyl (r,s)-3-benzyloxyglutarate

Suppliers and Price of Dimethyl 3-(benzyloxy)pentanedioate

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
Packaging
price

Total 1 raw suppliers

Chemical Property of Dimethyl 3-(benzyloxy)pentanedioate

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:266.11542367
Heavy Atom Count:19
Complexity:266

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CC(CC(=O)OC)OCC1=CC=CC=C1

Technology Process of Dimethyl 3-(benzyloxy)pentanedioate

There total 3 articles about Dimethyl 3-(benzyloxy)pentanedioate 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: 93.3%

: 7250-55-7
dimethyl 3-hydroxypentanedioate

: 81927-55-1
O-benzyl 2,2,2-trichloroacetimidate

: 112904-65-1
dimethyl 3-(benzyloxy)pentanedioate

Guidance literature:: With trifluoromethylsulfonic anhydride; In dichloromethane; cyclohexane; at 20 ℃; Inert atmosphere;

Reference yield: 67.0%

: 7250-55-7
dimethyl 3-hydroxypentanedioate

: 100-52-7
benzaldehyde

: 112904-65-1
dimethyl 3-(benzyloxy)pentanedioate

Guidance literature:: dimethyl 3-hydroxypentanedioate; With 1H-imidazole; chloro-trimethyl-silane; In dichloromethane; at 0 - 20 ℃;

benzaldehyde; With triethylsilane; iron(III) chloride; In acetonitrile;

Reference yield:

: 1830-54-2
3-oxopentanedioic acid dimethyl ester

: 112904-65-1
dimethyl 3-(benzyloxy)pentanedioate

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / NaBH₄

2: 70 percent / boron trifluoride - diethyl ether / cyclohexane; CH₂Cl₂ / 3 h / 23 °C

With sodium tetrahydroborate; boron trifluoride diethyl etherate; In dichloromethane; cyclohexane;
DOI:10.1139/v88-229