Benzyl levulinoyloxyacetate

Base Information

• Chemical Name: Benzyl levulinoyloxyacetate
• CAS No.: 53164-03-7
• Molecular Formula: C14H16O5
• Molecular Weight: 264.278
• DSSTox Substance ID: DTXSID301256483

Synonyms:benzyl levulinoyloxyacetate;SCHEMBL11273000;XMKMBGBKXMOQDH-UHFFFAOYSA-N;DTXSID301256483;53164-03-7;2-Oxo-2-(phenylmethoxy)ethyl 4-oxopentanoate

Chemical Property of Benzyl levulinoyloxyacetate

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 264.09977361
• Heavy Atom Count: 19
• Complexity: 318

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)CCC(=O)OCC(=O)OCC1=CC=CC=C1

Technology Process of Benzyl levulinoyloxyacetate

There total 1 articles about Benzyl levulinoyloxyacetate 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:

levulinic acid (123-76-2) + Benzyl bromoacetate (5437-45-6) → Laevulinoyloxyessigsaeurebenzylester (53164-03-7)

Guidance literature:

With potassium carbonate; Yield given. Multistep reaction; 1.) DMF, 70 min, 40 deg C, 2.) 4 h, 50 deg C;

Reference yield: 80.0%

4-methoxyphenylhydrazine hydrochloride (19501-58-7) + Laevulinoyloxyessigsaeurebenzylester (53164-03-7) → (5-Methoxy-2-methylindol-3-acetoxy)essigsaeurebenzylester (53164-08-2)

Guidance literature:

In acetic acid; 1.) 42 h, 28 deg C, 2.) 5 h, 50 deg C;

Reference yield: 10.0%

Laevulinoyloxyessigsaeurebenzylester (53164-03-7) + N1-(Phenoxycarbonyl)-N1-(4-methoxyphenyl)hydrazin-hydrochlorid → <1-(Phenoxycarbonyl)-5-methoxy-2-methylindol-3-acetoxy>essigsaeurebenzylester (343859-40-5)

Guidance literature:

In acetic acid; at 80 ℃; for 5h;

upstream raw materials:

levulinic acid

Benzyl bromoacetate

Downstream raw materials:

(5-Methoxy-2-methylindol-3-acetoxy)essigsaeurebenzylester

<1-(Phenoxycarbonyl)-5-methoxy-2-methylindol-3-acetoxy>essigsaeurebenzylester

Laevulinoyloxyessigsaeurebenzylester-(4-methoxyphenyl)-hydrazon

(1-Benzoyl-5-methoxy-2-methyl-1H-indol-3-yl)-acetic acid benzyloxycarbonylmethyl ester

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