2-(3-Methyl-1H-indol-2-yl)phenol

Base Information

• Chemical Name: 2-(3-Methyl-1H-indol-2-yl)phenol
• CAS No.: 31159-31-6
• Molecular Formula: C15H13NO
• Molecular Weight: 223.274
• DSSTox Substance ID: DTXSID30569756
• Nikkaji Number: J2.990.732C
• Wikidata: Q82456972
• Mol file: 31159-31-6.mol

Synonyms:2-(3-Methyl-1H-indol-2-yl)phenol;Oprea1_424697;31159-31-6;DTXSID30569756

Chemical Property of 2-(3-Methyl-1H-indol-2-yl)phenol

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 223.099714038
• Heavy Atom Count: 17
• Complexity: 268

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(NC2=CC=CC=C12)C3=CC=CC=C3O

Technology Process of 2-(3-Methyl-1H-indol-2-yl)phenol

There total 3 articles about 2-(3-Methyl-1H-indol-2-yl)phenol 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: 94.0%

1-(2-Hydroxy-phenyl)-propan-1-on (610-99-1) + phenylhydrazine (100-63-0) → 2-(2-hydroxyphenyl)-3-methylindole (31159-31-6)

Guidance literature:

With toluene-4-sulfonic acid; for 0.0833333h; Microwave irradiation; neat (no solvent);

DOI:10.1002/jhet.689

Reference yield: 80.0%

2-methyl benzofuran-3(2H)-one (35567-59-0) + phenylhydrazine (100-63-0) → 2-(2-hydroxyphenyl)-3-methylindole (31159-31-6)

Guidance literature:

With acetic acid; In water; at 60 ℃; for 4h;

DOI:10.1039/c6cc00365f

Reference yield:

→ 2-(2-hydroxyphenyl)-3-methylindole (31159-31-6)

Guidance literature:

entspr. Indol (II), LiAlH4;

DOI:10.1039/j39710000976

upstream raw materials:

1-(2-Hydroxy-phenyl)-propan-1-on

phenylhydrazine

2-methyl benzofuran-3(2H)-one

Downstream raw materials:

2-(3-methyl-1H-indol-2-yl)phenyl trifluoromethanesulfonate

1-chloro-3<2-(3-methylindol-2-yl)phenoxy>propane

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