2-(3-Bromo-phenylamino)-4-chlorobenzoic acid

Base Information

Chemical Name:2-(3-Bromo-phenylamino)-4-chlorobenzoic acid
CAS No.:97713-49-0
Molecular Formula:C13H9BrClNO2
Molecular Weight:326.577
Hs Code.:
DSSTox Substance ID:DTXSID80877373
Nikkaji Number:J469.251I
Wikidata:Q82859159

Synonyms:97713-49-0;SCHEMBL383535;DTXSID80877373;PLTVNLKTGUPGHQ-UHFFFAOYSA-N;2-(3-Bromo-phenylamino)-4-chlorobenzoic acid;Benzoic acid, 2-[(3-bromophenyl)amino]-4-chloro-

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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-(3-Bromo-phenylamino)-4-chlorobenzoic acid

Chemical Property:

XLogP3:6.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:324.95052
Heavy Atom Count:18
Complexity:303

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC(=C1)Br)NC2=C(C=CC(=C2)Cl)C(=O)O

Technology Process of 2-(3-Bromo-phenylamino)-4-chlorobenzoic acid

There total 2 articles about 2-(3-Bromo-phenylamino)-4-chlorobenzoic 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%

: 50-84-0
2,4 dichlorobenzoic acid

: 591-19-5
m-Bromoaniline

: 97713-49-0
2-(3-bromophenylamino)-4-chlorobenzoic acid

Guidance literature:: With potassium carbonate; copper; In N,N-dimethyl-formamide; at 140 - 150 ℃;
DOI:10.1007/BF00770449

Reference yield:

: 97713-49-0
2-(3-bromophenylamino)-4-chlorobenzoic acid

Guidance literature:

Reference yield:

: 97713-49-0
2-(3-bromophenylamino)-4-chlorobenzoic acid

: N-[2-(6-chloro-10-methyl-9-oxo-9,10-dihydro-acridin-1-yl)-phenyl]-2,2-dimethyl-propionamide

Guidance literature:: Multi-step reaction with 3 steps

1.1: H₂SO₄ / dimethyl ether / 0.5 h

2.1: NaH / dimethylformamide / 0.5 h

2.2: 0.625 g / dimethylformamide / 1 h

3.1: aq. NaHCO₃ / Pd(PPh₃)4 / 1,2-dimethoxy-ethane / Heating

With sulfuric acid; sodium hydride; sodium hydrogencarbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,2-dimethoxyethane; Dimethyl ether; N,N-dimethyl-formamide; 1.1: Friedel-Crafts cyclisation / 3.1: Suzuki coupling;
DOI:10.1039/b305177n