3'-Ketobutobarbitone
5-ethyl-5-(3-oxobutyl)-1,3-diazinane-2,4,6-trione
Also Known As: 3'-Ketobutobarbitone|5-ethyl-5-(3-oxobutyl)-1,3-diazinane-2,4,6-trione|5-ethyl-5-(3-oxobutyl)pyrimidine-2,4,6(1h,3h,5h)-trione|5-Ethyl-5-(3-oxobutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione|5-Ethyl-5-(3-oxobutyl)-hexahydropyrimidin-2,4,6-trione|5-Ethyl-5-(3-oxobutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione #
CAS: 6341-58-8
| Molecular Formula | C10H14N2O4 |
|---|---|
| Molecular Weight | 226.09535 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.09535 |
| Monoisotopic Mass | 226.09535 |
| Heavy Atoms | 16 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 6341-58-8 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)NC1=O)CCC(=O)C |
| InChIKey | HSOYKAKLDCBODZ-UHFFFAOYSA-N |
Product Overview
3'-Ketobutobarbitone (CAS 6341-58-8), with molecular formula C10H14N2O4 and molecular weight 226.09535 g/mol. IUPAC: 5-ethyl-5-(3-oxobutyl)-1,3-diazinane-2,4,6-trione.
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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