≥97% 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 | 488190526 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488190526 |
| Canonical Smiles | C1=CC(=CC=C1C(=O)NCC(=O)NCC(=O)O)[N+](=O)[O-] |
| IUPAC Name | 2-[[2-[(4-nitrobenzoyl)amino]acetyl]amino]acetic acid |
| InChIKey | WQJHGFSTRONKLC-UHFFFAOYSA-N |
| INCHI | 1S/C11H11N3O6/c15-9(12-6-10(16)17)5-13-11(18)7-1-3-8(4-2-7)14(19)20/h1-4H,5-6H2,(H,12,15)(H,13,18)(H,16,17) |
| Isomeric SMILES | C1=CC(=CC=C1C(=O)NCC(=O)NCC(=O)O)[N+](=O)[O-] |
| Molecular Weight | 281.22 |
| Reaxy-Rn | 3437221 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3437221&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 | Organic acids and derivatives |
| Class | Carboxylic acids and derivatives |
| Subclass | Amino acids, peptides, and analogues |
| Intermediate Tree Nodes | Peptides |
| Direct Parent | Dipeptides |
| Alternative Parents | Hippuric acids and derivatives N-acyl-alpha amino acids Alpha amino acid amides Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds Secondary carboxylic acid amides Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic oxoazanium compounds Organic oxides Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic zwitterions |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Nitrobenzene - Benzamide - Benzoic acid or derivatives - Benzoyl - Nitroaromatic compound - Benzenoid - Monocyclic benzene moiety - Carboxamide group - Secondary carboxylic acid amide - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic zwitterion - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. |
| 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 |
|---|---|---|---|
 D2306630 | Certificate of Analysis | Jan 21, 2026 | N331312 |
| D2306631 | Certificate of Analysis | Jan 21, 2026 | N331312 |
| D2306633 | Certificate of Analysis | Jan 21, 2026 | N331312 |
| D2306636 | Certificate of Analysis | Jan 21, 2026 | N331312 |
| Melt Point(°C) | 218 °C |
|---|---|
| Molecular Weight | 281.220 g/mol |
| XLogP3 | -1.000 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 281.065 Da |
| Monoisotopic Mass | 281.065 Da |
| Topological Polar Surface Area | 141.000 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 397.000 |
| 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 |
