1-(1-Benzyl-5-hydroxy-2-methylindol-3-yl)ethanone

Base Information

Chemical Name:1-(1-Benzyl-5-hydroxy-2-methylindol-3-yl)ethanone
CAS No.:94004-61-2
Molecular Formula:C₁₈H₁₇NO₂
Molecular Weight:279.338
Hs Code.:
DSSTox Substance ID:DTXSID701320569
ChEMBL ID:CHEMBL1573971

Synonyms:MLS000777125;1-(1-benzyl-5-hydroxy-2-methylindol-3-yl)ethanone;1-(1-benzyl-5-hydroxy-2-methyl-1H-indol-3-yl)ethanone;CHEMBL1573971;DTXSID701320569;HMS2774A07;STK877682;AKOS000661525;94004-61-2;SMR000413521;Z56772303;1-(1-Benzyl-5-hydroxy-2-methyl-1H-indol-3-yl)-ethanone

Suppliers and Price of 1-(1-Benzyl-5-hydroxy-2-methylindol-3-yl)ethanone

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1-(1-Benzyl-5-hydroxy-2-methylindol-3-yl)ethanone

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:279.125928785
Heavy Atom Count:21
Complexity:377

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)O)C(=O)C

Technology Process of 1-(1-Benzyl-5-hydroxy-2-methylindol-3-yl)ethanone

There total 6 articles about 1-(1-Benzyl-5-hydroxy-2-methylindol-3-yl)ethanone 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: 79.0%

: 21396-42-9
4-benzylaminopent-3-en-2-one

: 106-51-4
p-benzoquinone

: 94004-61-2
1-(1-benzyl-5-hydroxy-2-methyl-1H-indol-3-yl)ethanone

Guidance literature:: With zinc(II) chloride; In dichloromethane; for 0.833333h;
DOI:10.1016/j.bioorg.2018.04.022

Reference yield: 77.0%

: 139932-84-6
(E)-4-(benzylamino)pent-3-en-2-one

: 106-51-4
p-benzoquinone

: 94004-61-2
1-(1-benzyl-5-hydroxy-2-methyl-1H-indol-3-yl)ethanone

Guidance literature:: With zinc(II) iodide; In dichloromethane; for 0.666667h; Heating;
DOI:10.1002/jhet.5570430410

Reference yield:

: 100-46-9
benzylamine

: 94004-61-2
1-(1-benzyl-5-hydroxy-2-methyl-1H-indol-3-yl)ethanone

Guidance literature:: Multi-step reaction with 2 steps

1: toluene-4-sulfonic acid / methanol / 2 h / 45 °C / Reflux

2: zinc(II) chloride / dichloromethane / 0.83 h

With toluene-4-sulfonic acid; zinc(II) chloride; In methanol; dichloromethane;
DOI:10.1016/j.bioorg.2018.04.022