METHYL (5-FLUORO-1H-INDOL-3-YL)(OXO)ACETATE

Base Information

• Chemical Name: METHYL (5-FLUORO-1H-INDOL-3-YL)(OXO)ACETATE
• CAS No.: 408356-39-8
• Molecular Formula: C11H8FNO3
• Molecular Weight: 221.188
• Hs Code.: 2933998090
• Mol file: 408356-39-8.mol

Synonyms:METHYL (5-FLUORO-1H-INDOL-3-YL)(OXO)ACETATE;METHYL 2-(5-FLUORO-1H-INDOL-3-YL)-2-OXOACETATE;TIMTEC-BB SBB014389;5-Fluoro-alpha-oxo-1H-indole-3-acetic acid methyl ester;Methyl 2-(5-Fluoro-1H-indol-3-yl)oxoacetate;1H-INDOLE-3-ACETIC ACID, 5-FLUORO-α-OXO-, METHYL ESTER

Chemical Property of METHYL (5-FLUORO-1H-INDOL-3-YL)(OXO)ACETATE

Chemical Property:

• PSA: 59.16000
• LogP: 1.66270
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

97% ^*data from raw suppliers

1H-INDOLE-3-ACETICACID,5-FLUORO-α-OXO-,METHYLESTER 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of METHYL (5-FLUORO-1H-INDOL-3-YL)(OXO)ACETATE

There total 8 articles about METHYL (5-FLUORO-1H-INDOL-3-YL)(OXO)ACETATE 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: 87.0%

5-fluoro-1H-indole (399-52-0) + oxalyl dichloride (79-37-8) + sodium methylate (124-41-4) → methyl 2-(5-fluoro-1H-indol-3-yl)-2-oxoacetate (408356-39-8)

Guidance literature:

5-fluoro-1H-indole; oxalyl dichloride; In diethyl ether; at 0 ℃; for 0.5h;

sodium methylate; In methanol; diethyl ether; at -78 - 20 ℃;

Reference yield: 72.0%

5-fluoro-1H-indole (399-52-0) + oxalyl dichloride (79-37-8) → methyl 2-(5-fluoro-1H-indol-3-yl)-2-oxoacetate (408356-39-8)

Guidance literature:

With sodium methylate; In methanol; dichloromethane;

Reference yield: 66.0%

monomethyl oxalyl chloride (5781-53-3) + 5-fluoro-1H-indole (399-52-0) → methyl 2-(5-fluoro-1H-indol-3-yl)-2-oxoacetate (408356-39-8)

Guidance literature:

5-fluoro-1H-indole; With diethylaluminium chloride; In hexane; dichloromethane; at 0 ℃; for 0.5h;

monomethyl oxalyl chloride; In hexane; dichloromethane; at 0 ℃; for 3h;

DOI:10.1039/c8ob00642c

upstream raw materials:

sodium methylate

2-(5-fluoro-1H-indol-3-yl)-2-oxoacetyl chloride

5-fluoro-1H-indole

oxalyl dichloride

Downstream raw materials:

C₁₉H₁₄FN₃O₂

5-fluorotryptamine

Refernces

• 1、 -. "Preparation method and application of multi-target inhibitor acting on QC and GSK-3beta". Paragraph 0076-0078. . Retrieved 2020/04/17.
• 2、 Hu, Yuanyuan,Gao, Anhui,Liao, Honghui,Zhang, Mengmeng,Xu, Gaoya,Gao, Lixin,Xu, Lei,Zhou, Yubo,Gao, Jianrong,Ye, Qing,Li, Jia. "3-(7-Azaindolyl)-4-indolylmaleimides as a novel class of mutant isocitrate dehydrogenase-1 inhibitors: Design, synthesis, and biological evaluation". . . Retrieved 2018/09/06.