2-(5-Trifluoromethyl-1H-indol-3-yl)acetic acid

Base Information

• Chemical Name: 2-(5-Trifluoromethyl-1H-indol-3-yl)acetic acid
• CAS No.: 378802-40-5
• Molecular Formula: C11H8F3NO2
• Molecular Weight: 243.18
• Mol file: 378802-40-5.mol

Synonyms:2-(5-(trifluoromethyl)-1H-indol-3-yl)acetic acid;

Chemical Property of 2-(5-Trifluoromethyl-1H-indol-3-yl)acetic acid

Chemical Property:

• Boiling Point: 405.098 °C at 760 mmHg
• PKA: 4.30±0.30(Predicted)
• Flash Point: 198.797 °C
• PSA: 53.09000
• Density: 1.494 g/cm³
• LogP: 2.81380

Purity/Quality:

97% ^*data from raw suppliers

2-(5-Trifluoromethyl-1H-indol-3-yl)aceticacid 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 2-(5-Trifluoromethyl-1H-indol-3-yl)acetic acid

There total 4 articles about 2-(5-Trifluoromethyl-1H-indol-3-yl)acetic acid 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: 99.0%

methyl 2-(5-(trifluoromethyl)-1H-indol-3-yl)acetate → 2-(5-(trifluoromethyl)-1H-indol-3-yl)acetic acid (378802-40-5)

Guidance literature:

With water; lithium hydroxide; In tetrahydrofuran; methanol;

Reference yield: 1.5%

methyl 4,4-dimethoxybutanoate (4220-66-0) + 4-(trifluoromethyl)phenylhydrazine (368-90-1) → 2-(5-(trifluoromethyl)-1H-indol-3-yl)acetic acid (378802-40-5)

Guidance literature:

With sodium hydroxide; sulfuric acid; In methanol; water; ethyl acetate;

Reference yield:

5-trifluoromethyl-1H-indole (100846-24-0) → 2-(5-(trifluoromethyl)-1H-indol-3-yl)acetic acid (378802-40-5)

Guidance literature:

Multi-step reaction with 3 steps

1: diethyl ether / 0.25 h

2: sodium hypophosphite monohydrate; palladium on activated charcoal / water; 1,4-dioxane / 125 °C

3: lithium hydroxide; water / tetrahydrofuran; methanol

With sodium hypophosphite monohydrate; palladium on activated charcoal; water; lithium hydroxide; In tetrahydrofuran; 1,4-dioxane; methanol; diethyl ether; water;

upstream raw materials:

methyl 4,4-dimethoxybutanoate

4-(trifluoromethyl)phenylhydrazine

5-trifluoromethyl-1H-indole

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