2-(1H-Pyrrol-1-yl)benzeneacetic acid

Base Information

Chemical Name:2-(1H-Pyrrol-1-yl)benzeneacetic acid
CAS No.:55540-39-1
Molecular Formula:C₁₂H₁₁NO₂
Molecular Weight:201.225
Hs Code.:
DSSTox Substance ID:DTXSID401291785

Synonyms:2-(1H-Pyrrol-1-yl)benzeneacetic acid;Oprea1_490369;55540-39-1;DTXSID401291785;AKOS011825059

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

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Chemical Property of 2-(1H-Pyrrol-1-yl)benzeneacetic acid

Chemical Property:

XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:201.078978594
Heavy Atom Count:15
Complexity:224

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C(=C1)CC(=O)O)N2C=CC=C2

Technology Process of 2-(1H-Pyrrol-1-yl)benzeneacetic acid

There total 5 articles about 2-(1H-Pyrrol-1-yl)benzeneacetic acid 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: 52.0%

: 133662-32-5
2-(1-pyrrolyl)diazoacetophenone

: 55540-39-1
acide 2-(1-pyrrolyl)phenyl acetique

Guidance literature:: With sodium carbonate; sodium thiosulfate; silver(l) oxide; In 1,4-dioxane; a) 60 deg C, 1 h, b) 90 deg C, 10 min;

Reference yield:

: 2437-42-5
1-o-tolyl-1H-pyrrole

: 124-38-9,18923-20-1
carbon dioxide

: 55540-39-1
acide 2-(1-pyrrolyl)phenyl acetique

: 35524-49-3
1-(2'-Methylphenyl)-2-carboxypyrrol

Guidance literature:: 1-o-tolyl-1H-pyrrole; With n-butyllithium; N,N,N',N'',N'''-pentamethyldiethylenetriamine; In tetrahydrofuran; at -75 ℃; for 1h;

carbon dioxide; In tetrahydrofuran; at -75 ℃;

Reference yield:

: 10333-68-3
1-(2-carboxyphenyl)pyrrole

: 55540-39-1
acide 2-(1-pyrrolyl)phenyl acetique

Guidance literature:: Multi-step reaction with 3 steps

1: 49 percent / phosphorus pentachloride / benzene / 3 h / 5 °C

2: 58 percent / diethyl ether / 15 h / Ambient temperature

3: 52 percent / silver oxide, sodium carbonate, sodium thiosulfate / dioxane / a) 60 deg C, 1 h, b) 90 deg C, 10 min

With phosphorus pentachloride; sodium carbonate; sodium thiosulfate; silver(l) oxide; In 1,4-dioxane; diethyl ether; benzene;