Determine the necessary mass, volume, or concentration for preparing a solution.
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≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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.
| Sonrisas canónicas | C1=NC(=C2C(=N1)NC(=S)N2)N |
|---|---|
| IUPAC Name | 6-amino-7,9-dihydropurine-8-thione |
| InChIKey | BHVOFCPOXNYVCE-UHFFFAOYSA-N |
| INCHI | 1S/C5H5N5S/c6-3-2-4(8-1-7-3)10-5(11)9-2/h1H,(H4,6,7,8,9,10,11) |
| Isómeros SMILES | C1=NC(=C2C(=N1)NC(=S)N2)N |
| Peso molecular | 167.19 |
| Reaxy-Rn | 151790 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=151790&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 | Imidazopyrimidines |
| Subclass | Purines and purine derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Purinethiones |
| Alternative Parents | 6-aminopurines Aminopyrimidines and derivatives Imidolactams Imidazolethiones Imidazoles Heteroaromatic compounds Thioureas Azacyclic compounds Primary amines Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 6-aminopurine - Purinethione - Aminopyrimidine - Imidazole-2-thione - Imidolactam - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Thiourea - Azacycle - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Primary amine - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as purinethiones. These are purines in which the purine moiety bears a thioketone. |
| External Descriptors | Not available |
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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 | Sep 20, 2024 | M337441 | |
| Certificate of Analysis | Sep 20, 2024 | M337441 | |
| Certificate of Analysis | Sep 20, 2024 | M337441 | |
| Certificate of Analysis | Sep 20, 2024 | M337441 | |
| Certificate of Analysis | Sep 20, 2024 | M337441 | |
| Certificate of Analysis | Sep 20, 2024 | M337441 |
| Punto de fusión (°C) | 370-375 °C |
|---|---|
| Peso molecular | 167.190 g/mol |
| XLogP3 | -0.600 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 167.027 Da |
| Monoisotopic Mass | 167.027 Da |
| Topological Polar Surface Area | 108.000 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 184.000 |
| 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 |