5,6-dimethoxy-2-methyl-1H-indole

Base Information

• Chemical Name: 5,6-dimethoxy-2-methyl-1H-indole
• CAS No.: 57330-45-7
• Molecular Formula: C11H13 N O2
• Molecular Weight: 191.2264
• NSC Number: 105316
• DSSTox Substance ID: DTXSID80295750
• Wikidata: Q82035876
• Mol file: 57330-45-7.mol

Synonyms:5,6-dimethoxy-2-methyl-1H-indole;57330-45-7;5,6-dimethoxy-2-methylindole;NSC105316;NCIOpen2_002153;SCHEMBL266817;DTXSID80295750;ZMMVNMYKBFCJDA-UHFFFAOYSA-N;NSC-105316

Chemical Property of 5,6-dimethoxy-2-methyl-1H-indole

Chemical Property:

• Vapor Pressure: 0.000289mmHg at 25°C
• Boiling Point: 332.1°Cat760mmHg
• Flash Point: 121.6°C
• Density: 1.15g/cm³
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 191.094628657
• Heavy Atom Count: 14
• Complexity: 198

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=CC(=C(C=C2N1)OC)OC

Technology Process of 5,6-dimethoxy-2-methyl-1H-indole

There total 16 articles about 5,6-dimethoxy-2-methyl-1H-indole 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: 96.0%

C18H19NO2 → 5,6-dimethoxy-2-methyl-1H-indole (57330-45-7)

Guidance literature:

With ammonia; sodium; In tert-butyl alcohol; at -78 ℃; for 0.5h; Sealed tube; Inert atmosphere;

DOI:10.1002/anie.201806490

Reference yield: 93.0%

1-(2-nitro-4,5-dimethoxyphenyl)-2-nitropropene (86712-40-5) → 5,6-dimethoxy-2-methyl-1H-indole (57330-45-7)

Guidance literature:

With silica gel; iron; In cyclohexane; acetic acid; benzene; for 1h; Heating;

DOI:10.1021/jo00167a045

Reference yield: 83.0%

1-benzenesulfonyl-5,6-dimethoxy-2-methylindole → 5,6-dimethoxy-2-methyl-1H-indole (57330-45-7)

Guidance literature:

With water; sodium hydroxide; In ethanol; at 90 ℃; for 60h; Inert atmosphere;

DOI:10.1016/j.ejmech.2016.06.016

upstream raw materials:

1-(2-nitro-4,5-dimethoxyphenyl)-2-nitropropene

N-(tert-butoxycarbonyl)-5,6-dimethoxy-2-methylindole

N-(tert-butoxycarbonyl)-5,6-dimethoxyindole

5,6-dimethoxyindole

Downstream raw materials:

1-[(5,6-dimethoxy-2-methyl-indol-3-yl)-oxo-acetyl]-4-(4-trifluoromethyl-phenoxy)-piperidine

Refernces

• 1、 Huang, Zheng,Kwon, Ohhyeon,Huang, Haiyan,Fadli, Aziz,Marat, Xavier,Moreau, Magali,Lumb, Jean-Philip. "A Bioinspired Synthesis of Polyfunctional Indoles". . p. 11963 - 11967. Retrieved 2018/09/11.
• 2、 -. "FAAH INHIBITORS". Page/Page column 129-130. . Retrieved 2012/07/13.