3,3-Diacetyl-propionic acid-benzylester

Base Information

Chemical Name:3,3-Diacetyl-propionic acid-benzylester
CAS No.:70598-04-8
Molecular Formula:C₁₄H₁₆O₄
Molecular Weight:248.279
Hs Code.:
DSSTox Substance ID:DTXSID801225887

Synonyms:SCHEMBL1195221;WUVQQPXEIYAADQ-UHFFFAOYSA-N;DTXSID801225887;3,3-diacetyl-propionic acid-benzylester;Pentanoic acid, 3-acetyl-4-oxo-, phenylmethyl ester;70598-04-8

Suppliers and Price of 3,3-Diacetyl-propionic acid-benzylester

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

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Chemical Property of 3,3-Diacetyl-propionic acid-benzylester

Chemical Property:

XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:248.10485899
Heavy Atom Count:18
Complexity:302

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=O)C(CC(=O)OCC1=CC=CC=C1)C(=O)C

Technology Process of 3,3-Diacetyl-propionic acid-benzylester

There total 2 articles about 3,3-Diacetyl-propionic acid-benzylester 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: 90.0%

: 123-54-6,81235-32-7
acetylacetone

: 5437-45-6
Benzyl bromoacetate

: 70598-04-8
benzyl 3-acetyl-4-oxopentanoate

Guidance literature:: acetylacetone; With sodium hydride; In tetrahydrofuran; at 0 ℃; for 1h; Inert atmosphere;

Benzyl bromoacetate; In tetrahydrofuran; at 0 - 20 ℃; Inert atmosphere;
DOI:10.1039/c0nj00256a