Benzyl 4-hydroxy-1H-indole-1-carboxylate

Base Information

Chemical Name:Benzyl 4-hydroxy-1H-indole-1-carboxylate
CAS No.:75201-79-5
Molecular Formula:C16H13NO3
Molecular Weight:267.284
Hs Code.:
DSSTox Substance ID:DTXSID70504646
Nikkaji Number:J2.227.672G
Wikidata:Q82359288

Synonyms:Benzyl 4-hydroxy-1H-indole-1-carboxylate;Benzyl 4-hydroxyindole-1-carboxylate;75201-79-5;SCHEMBL3375069;DTXSID70504646;HDCDVKFQYKJZFG-UHFFFAOYSA-N

Suppliers and Price of Benzyl 4-hydroxy-1H-indole-1-carboxylate

Supply Marketing:

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

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Chemical Property of Benzyl 4-hydroxy-1H-indole-1-carboxylate

Chemical Property:

XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:267.08954328
Heavy Atom Count:20
Complexity:341

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)COC(=O)N2C=CC3=C2C=CC=C3O

Technology Process of Benzyl 4-hydroxy-1H-indole-1-carboxylate

There total 3 articles about Benzyl 4-hydroxy-1H-indole-1-carboxylate 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: 70.0%

: 868947-78-8
benzyl 4-(tert-butyldimethylsilyloxy)indole-1-carboxylate

: 75201-79-5
benzyl 4-hydroxyindole-1-carboxylate

Guidance literature:: With tetrabutyl ammonium fluoride; acetic acid; In tetrahydrofuran; at 0 ℃; for 0.666667h;
DOI:10.1002/jhet.5570420610

Reference yield:

: 106792-40-9
4-((tert-butyldimethylsilyl)oxy)-1H-indole

: 75201-79-5
benzyl 4-hydroxyindole-1-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 100 percent / tetrabutylammonium bromide; sodium hydroxide / CH₂Cl₂ / 18 h / 20 °C

2: 70 percent / acetic acid; tetrabutylammonium fluoride / tetrahydrofuran / 0.67 h / 0 °C

With sodium hydroxide; tetrabutyl ammonium fluoride; tetrabutylammomium bromide; acetic acid; In tetrahydrofuran; dichloromethane;
DOI:10.1002/jhet.5570420610

Reference yield:

: 2380-94-1
1H-indol-4-ol

: 75201-79-5
benzyl 4-hydroxyindole-1-carboxylate

Guidance literature:: Multi-step reaction with 3 steps

1: 85 percent / imidazole / CH₂Cl₂ / 20 °C

2: 100 percent / tetrabutylammonium bromide; sodium hydroxide / CH₂Cl₂ / 18 h / 20 °C

3: 70 percent / acetic acid; tetrabutylammonium fluoride / tetrahydrofuran / 0.67 h / 0 °C

With 1H-imidazole; sodium hydroxide; tetrabutyl ammonium fluoride; tetrabutylammomium bromide; acetic acid; In tetrahydrofuran; dichloromethane;
DOI:10.1002/jhet.5570420610