2-Amino-5-bromo-4-chlorobenzoic acid

Base Information

• Chemical Name: 2-Amino-5-bromo-4-chlorobenzoic acid
• CAS No.: 50419-88-0
• Molecular Formula: C7H5BrClNO2
• Molecular Weight: 250.479
• Hs Code.: 2922499990
• European Community (EC) Number: 963-822-7
• DSSTox Substance ID: DTXSID00599080
• Wikidata: Q72438493
• Mol file: 50419-88-0.mol

Synonyms:2-Amino-5-bromo-4-chlorobenzoic acid;50419-88-0;5-Bromo-4-chloroanthranilic acid;2-amino-5-bromo-4-chlorobenzoicacid;BUTTPARK 80\07-66;MFCD06409111;Benzoic acid, 2-amino-5-bromo-4-chloro-;2-amino-5-bromo-4-chloro-benzoic acid;BENZOIC ACID,2-AMINO-5-BROMO-4-CHLORO-;SCHEMBL856256;AMY4688;DTXSID00599080;TUDNMLBIHIWVJM-UHFFFAOYSA-N;AKOS016845863;AC-25286;AS-56849;SY276003;CS-0135790;EN300-122796

Chemical Property of 2-Amino-5-bromo-4-chlorobenzoic acid

Chemical Property:

• PSA: 63.32000
• Density: 1.892
• LogP: 2.96410
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 248.91922
• Heavy Atom Count: 12
• Complexity: 190

Purity/Quality:

97% ^*data from raw suppliers

2-Amino-5-bromo-4-chlorobenzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=CC(=C1Br)Cl)N)C(=O)O

Technology Process of 2-Amino-5-bromo-4-chlorobenzoic acid

There total 5 articles about 2-Amino-5-bromo-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: 98.0%

2-Amino-4-chlorobenzoic acid (89-77-0) → 2-amino-5-bromo-4-chlorobenzene carboxylic acid (50419-88-0)

Guidance literature:

With N-Bromosuccinimide; In acetonitrile; at 20 ℃; for 1h;

Reference yield: 94.0%

N-acetyl-5-bromo-4-chloroanthranilic acid (1607828-44-3) → 2-amino-5-bromo-4-chlorobenzene carboxylic acid (50419-88-0)

Guidance literature:

With water; sodium hydroxide; for 4h; Reflux;

DOI:10.1002/ejoc.201301198

Reference yield:

N-(4-bromo-5-chloro-2-methylphenyl)-acetamide (1607828-43-2) → 2-amino-5-bromo-4-chlorobenzene carboxylic acid (50419-88-0)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium permanganate; magnesium sulfate / water / 5.5 h / Reflux

2: sodium hydroxide; water / 4 h / Reflux

With potassium permanganate; water; magnesium sulfate; sodium hydroxide; In water;

DOI:10.1002/ejoc.201301198

upstream raw materials:

2-Amino-4-chlorobenzoic acid

N-(4-bromo-5-chloro-2-methylphenyl)-acetamide

N-(5-chloro-2-methylphenyl)acetamide

N-acetyl-5-bromo-4-chloroanthranilic acid

Downstream raw materials:

5-bromo-4-chloro-N-[(allyloxycarbonyl)methyl]anthranilic acid allyl ester

(5-bromo-6-chloroindol-3-yl)-β-D-galactopyranoside

2-amino-5-bromo-4-chlorobenzaldehyde

(2-amino-5-bromo-4-chlorophenyl)methanol

Refernces

• 1、 -. "5-bromo-6-chloro-3-indolyl caprylate synthesis method". Paragraph 0024; 0025; 0026; 0027; 0028; 0029; 0030. . Retrieved 2017/09/01.
• 2、 -. "INHIBITORS OF THE FIBROBLAST GROWTH FACTOR RECEPTOR". Paragraph 0407; 0408; 0409. . Retrieved 2015/05/05.