≥95%(N) 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488202853 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488202853 |
| Canonical Smiles | C1(=NC(=NC(=O)N1)N)N |
| IUPAC Name | 4,6-diamino-1H-1,3,5-triazin-2-one |
| InChIKey | MASBWURJQFFLOO-UHFFFAOYSA-N |
| INCHI | 1S/C3H5N5O/c4-1-6-2(5)8-3(9)7-1/h(H5,4,5,6,7,8,9) |
| Isomeric SMILES | C1(=NC(=NC(=O)N1)N)N |
| Molecular Weight | 127.11 |
| Beilstein | 26(2)132 |
| Reaxy-Rn | 5570 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5570&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 |
| Class | Triazines |
| Subclass | Triazinones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Triazinones |
| Alternative Parents | Aminotriazines 1,3,5-triazines Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Amino-1,3,5-triazine - Aminotriazine - Triazinone - 1,3,5-triazine - Heteroaromatic compound - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as triazinones. These are compounds containing a triazine ring which bears a ketone group a carbon atom. |
| External Descriptors | an aromatic compound |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 L2121152 | Certificate of Analysis | Oct 11, 2025 | A151174 |
| D2101228 | Certificate of Analysis | Jan 08, 2025 | A151174 |
| G2419141 | Certificate of Analysis | Apr 11, 2024 | A151174 |
| G2419142 | Certificate of Analysis | Apr 11, 2024 | A151174 |
| J2522050 | Certificate of Analysis | Apr 11, 2024 | A151174 |
| C2311758 | Certificate of Analysis | Jan 30, 2023 | A151174 |
| C2311760 | Certificate of Analysis | Jan 30, 2023 | A151174 |
| C2311761 | Certificate of Analysis | Jan 30, 2023 | A151174 |
| C2311765 | Certificate of Analysis | Jan 30, 2023 | A151174 |
| Solubility | Insoluble in water |
|---|---|
| Molecular Weight | 127.110 g/mol |
| XLogP3 | -1.800 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 127.049 Da |
| Monoisotopic Mass | 127.049 Da |
| Topological Polar Surface Area | 106.000 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 204.000 |
| 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 |
| 1. Qiaoling Yang, Bing Niu, Shuqing Gu, Jinge Ma, Chaomin Zhao, Qin Chen, Dehua Guo, Xiaojun Deng, Yongai Yu, Feng Zhang. (2022) Rapid Detection of Nonprotein Nitrogen Adulterants in Milk Powder Using Point-Scan Raman Hyperspectral Imaging Technology. ACS Omega, [PMID:35071894] [10.1021/acsomega.1c05533] |
