{2-[1-(Benzenesulfonyl)-1H-indol-2-yl]phenyl}methanol

Base Information

• Chemical Name: {2-[1-(Benzenesulfonyl)-1H-indol-2-yl]phenyl}methanol
• CAS No.: 88207-36-7
• Molecular Formula: C₂₁H₁₇NO₃S
• Molecular Weight: 363.437
• DSSTox Substance ID: DTXSID20527845
• Wikidata: Q82397065
• Mol file: 88207-36-7.mol

Synonyms:88207-36-7;{2-[1-(Benzenesulfonyl)-1H-indol-2-yl]phenyl}methanol;DTXSID20527845

Chemical Property of {2-[1-(Benzenesulfonyl)-1H-indol-2-yl]phenyl}methanol

Chemical Property:

• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 363.09291458
• Heavy Atom Count: 26
• Complexity: 566

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2C4=CC=CC=C4CO

Technology Process of {2-[1-(Benzenesulfonyl)-1H-indol-2-yl]phenyl}methanol

There total 4 articles about {2-[1-(Benzenesulfonyl)-1H-indol-2-yl]phenyl}methanol 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:

isoindolo[2,1-a]indol-6-one (4992-09-0) → 2-(2-hydroxymethylphenyl)-1-phenylsulphonylindole (88207-36-7)

Guidance literature:

Multi-step reaction with 4 steps

1: 67 percent / NaOH / methanol; H₂O / 0.25 h / Heating

2: 160 mg / LiAlH₄ / tetrahydrofuran / 2 h / Heating

3: 97 percent / pyridinium toluene-p-sulphonate / CH₂Cl₂ / 5 h / Ambient temperature

4: 1.) NaOH, tetra-n-butylammonium hydroxide, 2.) pyridinium toluene-p-sulphonate / 1.) THF, H₂O, 60 min, 2.) EtOH, 55 deg C, 24 h

With sodium hydroxide; lithium aluminium tetrahydride; tetra(n-butyl)ammonium hydroxide; pyridinium p-toluenesulfonate; In tetrahydrofuran; methanol; dichloromethane; water;

Reference yield:

2-(1H-indol-2-yl)benzoic acid (4992-08-9) → 2-(2-hydroxymethylphenyl)-1-phenylsulphonylindole (88207-36-7)

Guidance literature:

Multi-step reaction with 3 steps

1: 160 mg / LiAlH₄ / tetrahydrofuran / 2 h / Heating

2: 97 percent / pyridinium toluene-p-sulphonate / CH₂Cl₂ / 5 h / Ambient temperature

3: 1.) NaOH, tetra-n-butylammonium hydroxide, 2.) pyridinium toluene-p-sulphonate / 1.) THF, H₂O, 60 min, 2.) EtOH, 55 deg C, 24 h

With sodium hydroxide; lithium aluminium tetrahydride; tetra(n-butyl)ammonium hydroxide; pyridinium p-toluenesulfonate; In tetrahydrofuran; dichloromethane;

Reference yield:

2-(2-hydroxymethylphenyl)indole (88207-35-6) → 2-(2-hydroxymethylphenyl)-1-phenylsulphonylindole (88207-36-7)

Guidance literature:

Multi-step reaction with 2 steps

1: 97 percent / pyridinium toluene-p-sulphonate / CH₂Cl₂ / 5 h / Ambient temperature

2: 1.) NaOH, tetra-n-butylammonium hydroxide, 2.) pyridinium toluene-p-sulphonate / 1.) THF, H₂O, 60 min, 2.) EtOH, 55 deg C, 24 h

With sodium hydroxide; tetra(n-butyl)ammonium hydroxide; pyridinium p-toluenesulfonate; In dichloromethane;

upstream raw materials:

2-(2-tetrahydropyran-2-yloxymethylphenyl)indole

benzenesulfonyl chloride

isoindolo[2,1-a]indol-6-one

2-(1H-indol-2-yl)benzoic acid