3-Methyl-2-phenyl-3H-indole-3-ol

Base Information

• Chemical Name: 3-Methyl-2-phenyl-3H-indole-3-ol
• CAS No.: 1213-48-5
• Molecular Formula: C15H13 N O
• Molecular Weight: 223.274
• NSC Number: 180829
• DSSTox Substance ID: DTXSID00306872
• Nikkaji Number: J1.888.153E
• ChEMBL ID: CHEMBL1896394
• Mol file: 1213-48-5.mol

Synonyms:MLS003106935;1213-48-5;NSC180829;CHEMBL1896394;DTXSID00306872;NSC-180829;SMR001821819

Chemical Property of 3-Methyl-2-phenyl-3H-indole-3-ol

Chemical Property:

• Vapor Pressure: 3.67E-06mmHg at 25°C
• Boiling Point: 371°C at 760 mmHg
• Flash Point: 234.6°C
• Density: 1.14g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 223.099714038
• Heavy Atom Count: 17
• Complexity: 319

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2=CC=CC=C2N=C1C3=CC=CC=C3)O

Technology Process of 3-Methyl-2-phenyl-3H-indole-3-ol

There total 10 articles about 3-Methyl-2-phenyl-3H-indole-3-ol 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: 100.0%

3-Chlor-3-methyl-2-phenyl-indolenin (65837-35-6) → 3-hydroxy-3-methyl-2-phenyl-3H-indole (1213-48-5)

Guidance literature:

With hydrogenchloride; In acetonitrile; for 3h;

DOI:10.1021/jo00146a015

Reference yield: 87.0%

2-phenyl-3-methyl-1H-indole (10257-92-8) → 3-hydroxy-3-methyl-2-phenyl-3H-indole (1213-48-5)

Guidance literature:

With water; 1-Chloro-1H-indole-2,3-dione; In acetonitrile; for 3h; Ambient temperature;

DOI:10.1021/jo00146a015

Reference yield: 87.0%

2-phenyl-3H-indol-3-one (2989-63-1) + methylmagnesium bromide (75-16-1) → 2-methyl-2-phenyl-1,2-dihydro-3H-indol-3-one (3920-67-0) + 3-hydroxy-3-methyl-2-phenyl-3H-indole (1213-48-5)

Guidance literature:

In tetrahydrofuran; at 20 ℃;

DOI:10.1021/jo020715f

upstream raw materials:

2-phenyl-3-methyl-1H-indole

N-chlorobenzotriazole

3-Chlor-3-methyl-2-phenyl-indolenin

3-hydroperoxy-3-methyl-2-phenyl-3H-indole

Downstream raw materials:

2'-acetylbenzanilide

o-phenol

1-Phenylpropane-1,2-dione

(2S,3R)-3-Methyl-2-phenyl-2,3-dihydro-1H-indol-3-ol