5-Methoxy-6-methyl-1H-indole

Base Information

• Chemical Name: 5-Methoxy-6-methyl-1H-indole
• CAS No.: 3139-10-4
• Molecular Formula: C10H11NO
• Molecular Weight: 161.20000
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID80499771
• Wikidata: Q82350846
• Mol file: 3139-10-4.mol

Synonyms:5-Methoxy-6-methyl-1H-indole;3139-10-4;6-Methyl-5-methoxy indole;MFCD11007893;6-methyl-5-methoxyindole;1H-Indole, 5-methoxy-6-methyl-;5-Methoxy-6-methylindole;SCHEMBL187054;AMY9935;DTXSID80499771;AKOS006303215;AS-42654;SY243075;CS-0187157;FT-0715147;A847201;J-517695

Chemical Property of 5-Methoxy-6-methyl-1H-indole

Chemical Property:

• PSA: 25.02000
• LogP: 2.48490
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 161.084063974
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

97% ^*data from raw suppliers

5-methoxy-6-methyl-1H-indole 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=CN2)C=C1OC

Technology Process of 5-Methoxy-6-methyl-1H-indole

There total 3 articles about 5-Methoxy-6-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:

1-Methoxy-2-methyl-4-nitro-5-vinyl-benzene → 5-methoxy-6-methylindole (3139-10-4)

Guidance literature:

With iron; acetic acid; In ethanol; for 0.5h; Heating;

DOI:10.1021/jm00185a014

Reference yield:

1-methoxy-2,5-dimethyl-4-nitrobenzene (3139-06-8) → 5-methoxy-6-methylindole (3139-10-4)

Guidance literature:

Multi-step reaction with 2 steps

1: dimethylformamide / 96 h / 130 - 150 °C

2: 0.25 g / glacial CH₃COOH, Fe / ethanol / 0.5 h / Heating

With iron; acetic acid; In ethanol; N,N-dimethyl-formamide;

DOI:10.1021/jm00185a014

Reference yield:

→ 5-methoxy-6-methylindole (3139-10-4)

Guidance literature:

5-Methoxy-6-methyl-indol-2-carbonsaeure b. 300grad;

upstream raw materials:

1-methoxy-2,5-dimethyl-4-nitrobenzene

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