≥99% 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 | 488198215 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488198215 |
| Canonical Smiles | C1=CC(=CC=C1CC(=O)[O-])[N+](=O)[O-].[Na+] |
| IUPAC Name | sodium;2-(4-nitrophenyl)acetate |
| InChIKey | ZHBWMCGLXGDFAV-UHFFFAOYSA-M |
| INCHI | 1S/C8H7NO4.Na/c10-8(11)5-6-1-3-7(4-2-6)9(12)13;/h1-4H,5H2,(H,10,11);/q;+1/p-1 |
| Isomeric SMILES | C1=CC(=CC=C1CC(=O)[O-])[N+](=O)[O-].[Na+] |
| PubChem CID | 12675775 |
| Molecular Weight | 203.13 |
| Reaxy-Rn | 3577473 |
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 | Nitrobenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Nitrobenzenes |
| Alternative Parents | Nitroaromatic compounds Carboxylic acid salts Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Nitrobenzene - Nitroaromatic compound - Carboxylic acid salt - C-nitro compound - Organic nitro compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic alkali metal salt - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic salt - Organic sodium salt - Carbonyl group - Organic nitrogen compound - Organic cation - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group. |
| 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 |
|---|---|---|---|
 G2304893 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| G2304894 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| G2304895 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| G2304896 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| G2304897 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| G2304898 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| G2304899 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| G2304936 | Certificate of Analysis | Jun 10, 2023 | S161410 |
| Molecular Weight | 203.130 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 203.019 Da |
| Monoisotopic Mass | 203.019 Da |
| Topological Polar Surface Area | 86.000 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 197.000 |
| 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 | 2 |
