4-(2-IODO-PHENYL)-3-OXO-BUTYRIC ACID METHYL ESTER

Base Information

• Chemical Name: 4-(2-IODO-PHENYL)-3-OXO-BUTYRIC ACID METHYL ESTER
• CAS No.: 115860-27-0
• Molecular Formula: C11H11IO3
• Molecular Weight: 318.10800
• Mol file: 115860-27-0.mol

Synonyms:

Chemical Property of 4-(2-IODO-PHENYL)-3-OXO-BUTYRIC ACID METHYL ESTER

Chemical Property:

• PSA: 43.37000
• LogP: 1.96590

Purity/Quality:

2-IODO-BETA-OXO-BENZENE BUTANOIC ACID METHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-(2-IODO-PHENYL)-3-OXO-BUTYRIC ACID METHYL ESTER

There total 3 articles about 4-(2-IODO-PHENYL)-3-OXO-BUTYRIC ACID METHYL 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: 82.0%

methyl 3-amino-4-(2-iodophenyl)-2-butenoate (153974-32-4) → methyl 4-(2-iodophenyl)-3-oxobutanoate (115860-27-0)

Guidance literature:

With hydrogenchloride; In tetrahydrofuran; water; at 50 ℃; for 0.5h;

DOI:10.1016/S0040-4020(01)80765-1

Reference yield:

2-Iodobenzyl bromide (40400-13-3) → methyl 4-(2-iodophenyl)-3-oxobutanoate (115860-27-0)

Guidance literature:

Multi-step reaction with 3 steps

1: 84 percent / dimethylsulfoxide / 2 h / 70 °C

2: 75 percent / Zn / tetrahydrofuran / 10 h / Heating

3: 82 percent / 2N HCl / tetrahydrofuran; H₂O / 0.5 h / 50 °C

With hydrogenchloride; zinc; In tetrahydrofuran; water; dimethyl sulfoxide;

DOI:10.1016/S0040-4020(01)80765-1

Reference yield:

2-(2-iodophenyl)acetonitrile (40400-15-5) → methyl 4-(2-iodophenyl)-3-oxobutanoate (115860-27-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 75 percent / Zn / tetrahydrofuran / 10 h / Heating

2: 82 percent / 2N HCl / tetrahydrofuran; H₂O / 0.5 h / 50 °C

With hydrogenchloride; zinc; In tetrahydrofuran; water;

DOI:10.1016/S0040-4020(01)80765-1

upstream raw materials:

methyl 3-amino-4-(2-iodophenyl)-2-butenoate

2-Iodobenzyl bromide

2-(2-iodophenyl)acetonitrile

Refernces