2-Bromo-5-(1H-pyrrol-1-yl)benzoic Acid

Base Information

Chemical Name:2-Bromo-5-(1H-pyrrol-1-yl)benzoic Acid
CAS No.:354115-80-3
Molecular Formula:C₁₁H₈BrNO₂
Molecular Weight:266.094
Hs Code.:
European Community (EC) Number:843-771-6
Nikkaji Number:J1.527.714I

Synonyms:2-Bromo-5-(1H-pyrrol-1-yl)benzoic Acid;354115-80-3;2-bromo-5-pyrrol-1-ylbenzoic acid;SCHEMBL1786657;AXBOCLQRORPQAZ-UHFFFAOYSA-N;EN300-3321505;A1-18212;Z1480728342

Suppliers and Price of 2-Bromo-5-(1H-pyrrol-1-yl)benzoic Acid

Supply Marketing:

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

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Chemical Property of 2-Bromo-5-(1H-pyrrol-1-yl)benzoic Acid

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:264.97384
Heavy Atom Count:15
Complexity:241

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CN(C=C1)C2=CC(=C(C=C2)Br)C(=O)O

Technology Process of 2-Bromo-5-(1H-pyrrol-1-yl)benzoic Acid

There total 3 articles about 2-Bromo-5-(1H-pyrrol-1-yl)benzoic 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: 68.0%

: 696-59-3
cis,trans-2,5-dimethoxytetrahydrofuran

: 2840-02-0
5-acetamido-2-bromobenzoic acid

: 354115-80-3
1-(4-Bromo-3-carboxyphenyl)pyrrole

Guidance literature:: With acetic acid; at 120 ℃; for 0.5h;

Reference yield:

: 5044-39-3
1-(4-bromophenyl)-1H-pyrrole

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

: 22106-33-8
4-(1H-pyrrole-1-yl)benzoic acid

: 354115-80-3
1-(4-Bromo-3-carboxyphenyl)pyrrole

Guidance literature:: 1-(4-bromophenyl)-1H-pyrrole; With 2,2,6,6-tetramethylpiperidinyl-lithium; In tetrahydrofuran; at -75 ℃; for 1h;

carbon dioxide; In tetrahydrofuran; diethyl ether; at 20 ℃; Further stages.;
DOI:10.1039/b100008j

Reference yield:

: 106-40-1
4-bromo-aniline

: 354115-80-3
1-(4-Bromo-3-carboxyphenyl)pyrrole

Guidance literature:: Multi-step reaction with 2 steps

1.1: 81 percent / acetic acid

2.1: lithium 2,2,6,6-tetramethylpiperidine / tetrahydrofuran / 1 h / -75 °C

2.2: tetrahydrofuran; diethyl ether / 20 °C

With 2,2,6,6-tetramethylpiperidinyl-lithium; In tetrahydrofuran; acetic acid;
DOI:10.1039/b100008j