≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488199956 |
|---|---|
| Canonical Smiles | C1=CC(=C(C(=C1)N)Br)C(=O)O |
| IUPAC Name | 3-amino-2-bromobenzoic acid |
| InChIKey | PAGROCHVTXMVTP-UHFFFAOYSA-N |
| INCHI | 1S/C7H6BrNO2/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3H,9H2,(H,10,11) |
| Isomeric SMILES | C1=CC(=C(C(=C1)N)Br)C(=O)O |
| UN Number | 2811 |
| Packing Group | III |
| Molecular Weight | 216.03 |
| Reaxy-Rn | 27735247 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=27735247&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Aminobenzoic acids and derivatives |
| Direct Parent | Aminobenzoic acids |
| Alternative Parents | Halobenzoic acids 2-halobenzoic acids Benzoic acids Benzoyl derivatives 2-bromoanilines 1-carboxy-2-haloaromatic compounds Bromobenzenes Aryl bromides Vinylogous halides Amino acids Primary amines Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Aminobenzoic acid - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid - Halobenzoic acid - Benzoic acid - Benzoyl - 1-carboxy-2-haloaromatic compound - Aniline or substituted anilines - 2-bromoaniline - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Vinylogous halide - Amino acid - Amino acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organic oxide - Organonitrogen compound - Amine - Organic oxygen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 G2115120 | Certificate of Analysis | Apr 07, 2024 | A167825 |
| G2115121 | Certificate of Analysis | Apr 07, 2024 | A167825 |
| G2115122 | Certificate of Analysis | Apr 07, 2024 | A167825 |
| C2308427 | Certificate of Analysis | Jul 20, 2021 | A167825 |
| C2612134 | Certificate of Analysis | Jul 20, 2021 | A167825 |
| E2323170 | Certificate of Analysis | Jul 20, 2021 | A167825 |
| G2115123 | Certificate of Analysis | Jul 20, 2021 | A167825 |
| Melt Point(°C) | 153-158 °C |
|---|---|
| Molecular Weight | 216.030 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 214.958 Da |
| Monoisotopic Mass | 214.958 Da |
| Topological Polar Surface Area | 63.300 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 163.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
