3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanone
3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one
Also Known As: 3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one|ACMC-20cjlb|Tebuconazole metabolite|3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one|EINECS 261-489-6|1,2,4-Triazol-1-ylpinacolin|1,2,4-triazol-1-yl-pinacolin|3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanone|1-1H-1,2,4-triazolyl pinacolone|HWG 1608-triazole-pinacoline (M18)|1-Butanone,3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-|1,2,4-TRIAZLOE-3,3-DIMETHYL-BUTANONE|905D321|3,3-dimethyl-1-[1,2,4]triazol-1-ylbutan-2-one|I14-7448|I14-7587|2,2-dimethyl-4-(1,2,4-triazol-1-yl)-butan-3-one|3,3-dimethyl-1(1,2,4-triazol-1-yl)-butan-2-one|3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone
| Molecular Formula | C8H13N3O |
|---|---|
| Molecular Weight | 167.10587 g/mol |
| LogP | 0.89 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.10587 |
| Heavy Atoms | 12 |
| Complexity | 258.3 |
Chemical Identifiers
| CAS Number | 58905-32-1 |
|---|---|
| SMILES | CC(C)(C)C(=O)CN1C=NC=N1 |
Product Overview
3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanone (CAS 58905-32-1), with molecular formula C8H13N3O and molecular weight 167.10587 g/mol. IUPAC: 3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one.
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