| Canonical Smiles | C1C(CNC(=S)N1)O |
|---|---|
| IUPAC Name | 5-hydroxy-1,3-diazinane-2-thione |
| InChIKey | GBUALRXLRRQXGH-UHFFFAOYSA-N |
| INCHI | 1S/C4H8N2OS/c7-3-1-5-4(8)6-2-3/h3,7H,1-2H2,(H2,5,6,8) |
| Molecular Weight | 132.19 |
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Diazinanes |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Diazinanes |
| Alternative Parents | Thioureas Secondary alcohols Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | 1,3-diazinane - Thiourea - Secondary alcohol - Azacycle - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as diazinanes. These are organic compounds containing diazinane, a six-membered saturated heterocycle containing four carbon atoms and two nitrogen atoms. |
| External Descriptors | Not available |
| Molecular Weight | 132.190 g/mol |
|---|---|
| XLogP3 | -0.900 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 132.036 Da |
| Monoisotopic Mass | 132.036 Da |
| Topological Polar Surface Area | 76.400 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 96.200 |
| 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 |
