≥98%(T) 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 | 488201784 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488201784 |
| Canonical Smiles | C1C(=O)NC(=S)NC1=O.[Na] |
| InChIKey | LHWPSDLHLAAELL-UHFFFAOYSA-N |
| INCHI | 1S/C4H4N2O2S.Na/c7-2-1-3(8)6-4(9)5-2;/h1H2,(H2,5,6,7,8,9); |
| Isomeric SMILES | C1C(=O)NC(=S)NC1=O.[Na] |
| PubChem CID | 56924476 |
| Molecular Weight | 166.13 |
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 |
| Class | Diazines |
| Subclass | Pyrimidines and pyrimidine derivatives |
| Intermediate Tree Nodes | Pyrimidones |
| Direct Parent | Thiobarbituric acid derivatives |
| Alternative Parents | Diazinanes 1,3-dicarbonyl compounds Thioureas Organic alkali metal salts Carboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Thiobarbiturate - 1,3-diazinane - 1,3-dicarbonyl compound - Thiourea - Carboxylic acid derivative - Azacycle - Organic alkali metal salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as thiobarbituric acid derivatives. These are organic compounds containing a 2-thioxodihydropyrimidine-4,6(1H,5H)-dione skeleton. |
| 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 |
|---|---|---|---|
 B2628213 | Certificate of Analysis | Mar 13, 2026 | S161323 |
| H2117388 | Certificate of Analysis | Jun 09, 2025 | S161323 |
| H2117389 | Certificate of Analysis | Jun 09, 2025 | S161323 |
| I2509624 | Certificate of Analysis | Jun 22, 2024 | S161323 |
| I2509634 | Certificate of Analysis | Jun 22, 2024 | S161323 |
| I2509676 | Certificate of Analysis | Jun 22, 2024 | S161323 |
| C1912161 | Certificate of Analysis | Jan 05, 2023 | S161323 |
| L2206143 | Certificate of Analysis | Dec 16, 2022 | S161323 |
| L2201103 | Certificate of Analysis | Dec 10, 2022 | S161323 |
| Molecular Weight | 167.140 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 166.989 Da |
| Monoisotopic Mass | 166.989 Da |
| Topological Polar Surface Area | 90.300 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 171.000 |
| 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 |
