Lot numbers can be found on the outside label of a product:
5-Bromoanthranilic acid
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CAS No. 5794-88-7
- Cat. No. CS-W009053
- Purity≥98%
- MDL No.MFCD00007823
*For research and further manufacturing use only, not for direct human use.
Structure of 5794-88-7
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General Information
- CAS No. 5794-88-7
- Cat. No. CS-W009053
- Purity ≥98%
- MDL No. MFCD00007823
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₇H₆BrNO₂
- Molecular Weight 216.03
- Synonym(s) 2-Amino-5-bromobenzoic acid; 4-Bromo-2-carboxyaniline; 5-Bromo-2-aminobenzoic acid; BUTTPARK 89\07-49
- SMILES O=C(O)C1=CC(Br)=CC=C1N
Description
5-Bromoanthranilic acid serves as a key building block in medicinal chemistry, featuring a bromine substituent at the para position relative to the carboxylic acid. This electron-deficient aromatic scaffold integrates readily into heterocyclic systems, enabling efficient access to bioactive compounds through coupling reactions. The molecule exhibits robust stability under standard conditions and facilitates downstream functionalization in synthetic sequences.
Application
5-Bromoanthranilic acid serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling direct incorporation of both bromine and carboxylic acid functionalities into heterocyclic scaffolds. Its ortho-amino and carboxyl groups facilitate efficient cyclization reactions, including Ullmann-type couplings and Pd-catalyzed C–N bond formations. The molecule exhibits good bench stability and is compatible with standard purification methods, making it ideal for use in multi-step syntheses requiring functional group tolerance and predictable reactivity.
Synthesis
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Route1
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In-stock
52727-57-8 - ~97%
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In-stock
5794-88-7
References
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TIBOTEC PHARMACEUTICALS; VANDYCK, Koen; VERSCHUEREN, Wim Gaston; RABOISSON, Pierre Jean-Marie Bernard Patent: WO2012/13643 A1, 2012 ; Location in patent: Page/Page column 43 ;
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Route2
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118-92-3 - ~98%
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In-stock
5794-88-7
References
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Bagmanov Russian Journal of Applied Chemistry, 2009 , vol. 82, # 9 p. 1570 - 1576
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Route3
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In-stock
6950-43-2 - ~91%
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In-stock
5794-88-7
References
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Abiraj, Keelara; Srinivasa, Gejjalagere R.; Gowda, D. Channe Australian Journal of Chemistry, 2005 , vol. 58, # 2 p. 149 - 151
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS06
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Signal Word : Danger
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UN#: 2811
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Class : 6.1
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Packing Group : Ⅲ
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Hazard Statements : H301-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 63.32
- LogP 1.7295
- H_Acceptors 2
- H_Donors 2
- Rotatable_Bonds 1
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Key Words
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