(2S)-6-Ethoxy-1,6-dioxohexan-2-yl benzoate

Base Information

Chemical Name:(2S)-6-Ethoxy-1,6-dioxohexan-2-yl benzoate
CAS No.:82493-58-1
Molecular Formula:C15H18O5
Molecular Weight:278.305
Hs Code.:
DSSTox Substance ID:DTXSID10553411
Wikidata:Q82433993
Mol file:82493-58-1.mol

Synonyms:82493-58-1;ETHYL-(5S)-BENZOYLOXY 6-OXOHEXENOATE;(2S)-6-Ethoxy-1,6-dioxohexan-2-yl benzoate;SCHEMBL10962086;DTXSID10553411;(S)-6-ethoxy-1,6-dioxohexan-2-yl benzoate

Suppliers and Price of (2S)-6-Ethoxy-1,6-dioxohexan-2-yl benzoate

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

American Custom Chemicals Corporation
ETHYL-(5S)-BENZOYLOXY-6-OXOHEXENOATE 95.00%
5MG
$ 502.66

Total 4 raw suppliers

Chemical Property of (2S)-6-Ethoxy-1,6-dioxohexan-2-yl benzoate

Chemical Property:

PSA：69.67000
LogP:2.14430
XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:278.11542367
Heavy Atom Count:20
Complexity:320

Purity/Quality:

97% ^*data from raw suppliers

ETHYL-(5S)-BENZOYLOXY-6-OXOHEXENOATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CCCC(C=O)OC(=O)C1=CC=CC=C1
Isomeric SMILES:CCOC(=O)CCC[C@@H](C=O)OC(=O)C1=CC=CC=C1

Technology Process of (2S)-6-Ethoxy-1,6-dioxohexan-2-yl benzoate

There total 18 articles about (2S)-6-Ethoxy-1,6-dioxohexan-2-yl benzoate 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: 99.0%

: 82493-57-0
ethyl 5-O-benzoyl-2,3,4-trideoxy-D-erythro-heptonate

: 82493-58-1
ethyl 2-O benzoyl-3,4,5-trideoxy-L-glycero-hexuronate

Guidance literature:: With lead(IV) acetate; sodium carbonate; In dichloromethane; at -40 ℃; for 0.583333h;
DOI:10.1021/jo00239a028

Reference yield: 73.0%

: 27983-42-2
5-carboethoxypentanal

: 65-85-0,8013-63-6
benzoic acid

: 82493-58-1,86535-40-2
6-ethoxy-1,6-dioxohexan-2-yl benzoate

Guidance literature:: With piperidine; tert.-butylhydroperoxide; tetra-(n-butyl)ammonium iodide; In ethyl acetate; at 20 - 50 ℃; for 4h;
DOI:10.1002/anie.201101522