≥98% 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 | 488188645 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488188645 |
| Canonical Smiles | C1=CC(=C(C(=C1)[N+](=O)[O-])N)C(=O)O |
| IUPAC Name | 2-amino-3-nitrobenzoic acid |
| InChIKey | JJPIVRWTAGQTPQ-UHFFFAOYSA-N |
| INCHI | 1S/C7H6N2O4/c8-6-4(7(10)11)2-1-3-5(6)9(12)13/h1-3H,8H2,(H,10,11) |
| Isomeric SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])N)C(=O)O |
| WGK Germany | 3 |
| Molecular Weight | 182.13 |
| Beilstein | 14(4)1087 |
| Reaxy-Rn | 2806580 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2806580&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 | Not available |
| Direct Parent | Nitrobenzoic acids and derivatives |
| Alternative Parents | Aminobenzoic acids Benzoic acids Nitrobenzenes Aniline and substituted anilines Benzoyl derivatives Nitroaromatic compounds Vinylogous amides Amino acids Organic oxoazanium compounds Monocarboxylic acids and derivatives Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Organic oxides Primary amines Hydrocarbon derivatives Organic zwitterions Organooxygen compounds Organopnictogen compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Nitrobenzoate - Aminobenzoic acid - Aminobenzoic acid or derivatives - Benzoic acid - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aniline or substituted anilines - Vinylogous amide - Amino acid or derivatives - Amino acid - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary amine - Organic zwitterion - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as nitrobenzoic acids and derivatives. These are compounds containing a nitrobenzoic acid moiety, which consists of a benzene ring bearing both a carboxylic acid group and a nitro group on two different ring carbon atoms. |
| 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 |
|---|---|---|---|
 F2610302 | Certificate of Analysis | May 12, 2026 | A107965 |
| F2610303 | Certificate of Analysis | May 12, 2026 | A107965 |
| F2610305 | Certificate of Analysis | May 12, 2026 | A107965 |
| H2520107 | Certificate of Analysis | Aug 25, 2025 | A107965 |
| H1507007 | Certificate of Analysis | Apr 12, 2023 | A107965 |
| L2216169 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| A2615123 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| L2216168 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| L2216167 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| L2216077 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| L2216076 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| L2216075 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| L2216052 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| L2216051 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| E2311106 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| B2324334 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| B2324333 | Certificate of Analysis | Nov 17, 2022 | A107965 |
| Melt Point(°C) | 207-211°C |
|---|---|
| Molecular Weight | 182.130 g/mol |
| XLogP3 | 1.100 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 182.033 Da |
| Monoisotopic Mass | 182.033 Da |
| Topological Polar Surface Area | 109.000 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 225.000 |
| 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 |
