6-acetyl-2-sulfanylidene-1H-pyrimidin-4-one
6-acetyl-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 6-acetyl-2-sulfanylidene-1H-pyrimidin-4-one|6-acetyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one|6-Acetyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
CAS: 7597-77-5
| Molecular Formula | C6H6N2O2S |
|---|---|
| Molecular Weight | 170.015 g/mol |
| LogP | 0.63509 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.015 |
| Monoisotopic Mass | 170.015 |
| Heavy Atoms | 11 |
| Complexity | 361.80902 |
Chemical Identifiers
| CAS Number | 7597-77-5 |
|---|---|
| SMILES | CC(=O)C1=CC(=O)NC(=S)N1 |
Product Overview
6-acetyl-2-sulfanylidene-1H-pyrimidin-4-one (CAS 7597-77-5), with molecular formula C6H6N2O2S and molecular weight 170.015 g/mol. IUPAC: 6-acetyl-2-sulfanylidene-1H-pyrimidin-4-one.
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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