AC1OF3B9
6-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]sulfanyl-2H-1,2,4-triazine-3,5-dione
Also Known As: 6-(((2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)thio)-1,2,4-triazine-3,5(2H,4H)-dione|6-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]sulfanyl-2H-1,2,4-triazine-3,5-dione
CAS: 89019-99-8
| Molecular Formula | C8H11N3O6S |
|---|---|
| Molecular Weight | 277.03687 g/mol |
| LogP | -3.0107 |
| Topological Polar Surface Area | 148.53 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.03687 |
| Monoisotopic Mass | 277.03687 |
| Heavy Atoms | 18 |
| Complexity | 530.05383 |
Chemical Identifiers
| CAS Number | 89019-99-8 |
|---|---|
| SMILES | C([C@@H]1[C@H]([C@H]([C@@H](O1)SC2=NNC(=O)NC2=O)O)O)O |
Product Overview
AC1OF3B9 (CAS 89019-99-8), with molecular formula C8H11N3O6S and molecular weight 277.03687 g/mol. IUPAC: 6-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]sulfanyl-2H-1,2,4-triazine-3,5-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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