Pentanedioic acid, 3-phenyl-, monoethyl ester

Base Information

• Chemical Name: Pentanedioic acid, 3-phenyl-, monoethyl ester
• CAS No.: 106842-97-1
• Molecular Formula: C13H16O4
• Molecular Weight: 236.268
• Mol file: 106842-97-1.mol

Synonyms:.3-phenyl-glutaric acid mono-ethyl ester;.3-Phenyl-glutarsaeure-monoaethylester;.3-phenyl-glutaric acid monoethyl ester;3-phenylglutaric acid monoethyl ester;

Chemical Property of Pentanedioic acid, 3-phenyl-, monoethyl ester

Chemical Property:

• PSA: 63.60000
• LogP: 2.19810

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Pentanedioic acid, 3-phenyl-, monoethyl ester

There total 4 articles about Pentanedioic acid, 3-phenyl-, monoethyl 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: 91.0%

3-phenylglutaric acid anhydride (4160-80-9) + ethanol (64-17-5) → 3-phenylpentanedioic acid monoethyl ester (106842-97-1)

Guidance literature:

With pyridine; for 3h; Heating;

DOI:10.1016/j.tet.2005.04.032

Reference yield:

3-phenylglutaric acid anhydride (4160-80-9) + ethyl 2-cyanoacetate (105-56-6) → 3-phenylpentanedioic acid monoethyl ester (106842-97-1)

Guidance literature:

With Novozym 435; at 20 ℃; for 672000h;

DOI:10.1016/j.tetasy.2006.03.002

Reference yield:

3-phenylglutaric acid (4165-96-2) → 3-phenylpentanedioic acid monoethyl ester (106842-97-1)

Guidance literature:

Multi-step reaction with 2 steps

1: AcCl / 3 h

2: 91 percent / pyridine / 2 h / Heating

With pyridine; acetyl chloride;

DOI:10.1016/j.tetasy.2005.06.025

upstream raw materials:

3-phenylglutaric acid anhydride

ethanol

ethyl 2-cyanoacetate

3-phenylglutaric acid

Downstream raw materials:

ethyl rac 4-[3-(2-guanidino-4-methyl-thiazol-5-yl)-phenylcarbamoyl]-3-phenyl-butyrate hydrochloride

4-phenyltetrahydropyran-2-one

5-hydroxy-3-phenyl-valeric acid

5-[2-(4-cyanophenyl)-1-oxo-2,8-diazaspiro[4.5]dec-8-yl]-5-oxo-3-phenylpentanoic acid ethyl ester

Refernces

• 1、 Meyer,R.B.,Hauser,C.R.. "-". . p. 3183 - 3186. Retrieved 1961.
• 2、 -. "TRICYCLIC MODULATORS OF TNF SIGNALING". Page/Page column 181; 182. . Retrieved 2016/11/02.