1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-3-ylthio)ethanone
1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone
Also Known As: SDCCGMLS-0022899.P002|VU0183510-5|F3394-1173|1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-3-ylthio)ethanone|SR-01000281778-1|1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone|1-(2H-1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-3-ylsulfanyl)ethan-1-one|1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone|1-(2H-1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-3-ylthio)-1-ethanone|2-((1H-1,2,4-triazol-3-yl)thio)-1-(benzo[d][1,3]dioxol-5-yl)ethanone
| Molecular Formula | C11H9N3O3S |
|---|---|
| Molecular Weight | 263.03647 g/mol |
| LogP | 1.5084 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.03647 |
| Monoisotopic Mass | 263.03647 |
| Heavy Atoms | 18 |
| Complexity | 570.91736 |
Chemical Identifiers
| CAS Number | 690646-72-1 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NC=NN3 |
Product Overview
1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-3-ylthio)ethanone (CAS 690646-72-1), with molecular formula C11H9N3O3S and molecular weight 263.03647 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone.
1-(1,3-benzodioxol-5-yl)-2-(1H-1,2,4-triazol-3-ylthio)ethanone is a custom synthesis product. We offer services from milligram to kilogram scale.
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