5-hexyl-3-((5-mercapto-4H-1,2,4-triazol-3-yl)methyl)dihydrofuran-2(3H)-one
5-hexyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-one
Also Known As: 5-hexyl-3-((5-mercapto-4H-1,2,4-triazol-3-yl)methyl)dihydrofuran-2(3H)-one|5-hexyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-one
CAS: 328068-89-9
| Molecular Formula | C13H21N3O2S |
|---|---|
| Molecular Weight | 283.13544 g/mol |
| LogP | 2.91189 |
| Topological Polar Surface Area | 70.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 283.13544 |
| Monoisotopic Mass | 283.13544 |
| Heavy Atoms | 19 |
| Complexity | 468.45343 |
Chemical Identifiers
| CAS Number | 328068-89-9 |
|---|---|
| SMILES | CCCCCCC1CC(C(=O)O1)CC2=NC(=S)NN2 |
Product Overview
5-hexyl-3-((5-mercapto-4H-1,2,4-triazol-3-yl)methyl)dihydrofuran-2(3H)-one (CAS 328068-89-9), with molecular formula C13H21N3O2S and molecular weight 283.13544 g/mol. IUPAC: 5-hexyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-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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5-hexyl-3-((5-mercapto-4H-1,2,4-triazol-3-yl)methyl)dihydrofuran-2(3H)-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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