4-(1-METHYL-1H-INDOL-3-YL)-BUTYRIC ACID

Base Information

• Chemical Name: 4-(1-METHYL-1H-INDOL-3-YL)-BUTYRIC ACID
• CAS No.: 16244-09-0
• Molecular Formula: C₁₃H₁₅NO₂
• Molecular Weight: 217.268
• Mol file: 16244-09-0.mol

Synonyms:

Chemical Property of 4-(1-METHYL-1H-INDOL-3-YL)-BUTYRIC ACID

Chemical Property:

• Melting Point: 103-104 °C(Solv: benzene (71-43-2); ligroine (8032-32-4))
• Boiling Point: 411.7±20.0 °C(Predicted)
• PKA: 4.79±0.10(Predicted)
• Density: 1.14±0.1 g/cm3(Predicted)

Purity/Quality:

98%min ^*data from raw suppliers

4-(1-Methyl-1H-indol-3-yl)-butyric acid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 22

MSDS Files:

Useful:

Technology Process of 4-(1-METHYL-1H-INDOL-3-YL)-BUTYRIC ACID

There total 4 articles about 4-(1-METHYL-1H-INDOL-3-YL)-BUTYRIC 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:

methyl 4-(1-methyl-1H-indol-3-yl)butanoic acid ester (149287-21-8) → 4-(1-methyl-1H-indol-3-yl)butanoic acid (16244-09-0)

Guidance literature:

methyl 4-(1-methyl-1H-indol-3-yl)butanoic acid ester; With potassium hydroxide; In water; at 100 ℃; for 4h;

With hydrogenchloride; In water;

DOI:10.1055/s-0029-1216904

Reference yield:

methyl bromide (74-83-9) + 4-indol-3-yl-butyric acid (133-32-4) → 4-(1-methyl-1H-indol-3-yl)butanoic acid (16244-09-0)

Guidance literature:

4-indol-3-yl-butyric acid; With sodium hydride; In N,N-dimethyl-formamide; at 0 ℃; for 0.5h; Inert atmosphere;

methyl bromide; In N,N-dimethyl-formamide; at 0 - 20 ℃; Inert atmosphere;

DOI:10.1080/14756366.2020.1870457

Reference yield:

→ 4-(1-methyl-1H-indol-3-yl)butanoic acid (16244-09-0)

Guidance literature:

With potassium hydroxide;

upstream raw materials:

methyl 4-(1-methyl-1H-indol-3-yl)butanoic acid ester

methyl bromide

4-indol-3-yl-butyric acid

Downstream raw materials:

1-Methyl-3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-butyl]-1H-indole

3-(4-acetylphenyl)-4-(1-methyl-1H-indol-3-yl)-N-(2-(pyridin-2-yl)propan-2-yl)butanamide

4-(1-Methyl-1H-indol-3-yl)-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-butan-1-one

Refernces

• 1、 Chen, Yiming,Zhang, Lihui,Zhang, Lin,Jiang, Qixiao,Zhang, Lei. "Discovery of indole-3-butyric acid derivatives as potent histone deacetylase inhibitors". . p. 425 - 436. Retrieved 2021/02/03.