Determine the necessary mass, volume, or concentration for preparing a solution.
≥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 | 504769651 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504769651 |
| Sonrisas canónicas | C1=C(NC(=O)NC1=O)C(=O)[O-].[Na+] |
| IUPAC Name | sodium;2,4-dioxo-1H-pyrimidine-6-carboxylate |
| InChIKey | ZTHMWDSJKLNDTE-UHFFFAOYSA-M |
| INCHI | 1S/C5H4N2O4.Na/c8-3-1-2(4(9)10)6-5(11)7-3;/h1H,(H,9,10)(H2,6,7,8,11);/q;+1/p-1 |
| Isómeros SMILES | C1=C(NC(=O)NC1=O)C(=O)[O-].[Na+] |
| WGK Alemania | 3 |
| RTECS | RM3201700 |
| Peso molecular | 178.08 |
| Reaxy-Rn | 6025939 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6025939&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 | Organoheterocyclic compounds |
| Clase | Diazines |
| Subclass | Pyrimidines and pyrimidine derivatives |
| Intermediate Tree Nodes | Pyrimidinecarboxylic acids and derivatives |
| Direct Parent | Pyrimidinecarboxylic acids |
| Alternative Parents | Hydropyrimidine carboxylic acids and derivatives Pyrimidones Vinylogous amides Heteroaromatic compounds Ureas Carboxylic acid salts Lactams Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organic sodium salts Organonitrogen compounds Organooxygen compounds Organopnictogen compounds |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Hydropyrimidine carboxylic acid derivative - Pyrimidine-6-carboxylic acid - Pyrimidone - Hydropyrimidine - Vinylogous amide - Heteroaromatic compound - Carboxylic acid salt - Lactam - Urea - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organic alkali metal salt - Azacycle - Hydrocarbon derivative - Organic salt - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic sodium salt - Aromatic heteromonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Aug 14, 2024 | O335642 | |
| Certificate of Analysis | Aug 14, 2024 | O335642 | |
| Certificate of Analysis | Aug 14, 2024 | O335642 | |
| Certificate of Analysis | Aug 14, 2024 | O335642 | |
| Certificate of Analysis | Aug 14, 2024 | O335642 |
| Índice de refracción | n20D1.57 ± 0.02 (Predicted) |
|---|---|
| Peso molecular | 178.080 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 177.999 Da |
| Monoisotopic Mass | 177.999 Da |
| Topological Polar Surface Area | 98.300 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 273.000 |
| 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 |