2-Phenyl-4-propargyl-1,3,4-thiadiazolin-5-one
5-phenyl-3-prop-2-ynyl-1,3,4-thiadiazol-2-one
Also Known As: 2-phenyl-4-propargyl-1,3,4-thiadiazolin-5-one|5-phenyl-3-prop-2-ynyl-1,3,4-thiadiazol-2-one
CAS: 97051-27-9
| Molecular Formula | C11H8N2OS |
|---|---|
| Molecular Weight | 216.03574 g/mol |
| LogP | 1.605 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.03574 |
| Monoisotopic Mass | 216.03574 |
| Heavy Atoms | 15 |
| Complexity | 547.95715 |
Chemical Identifiers
| CAS Number | 97051-27-9 |
|---|---|
| SMILES | C#CCN1C(=O)SC(=N1)C2=CC=CC=C2 |
Product Overview
2-Phenyl-4-propargyl-1,3,4-thiadiazolin-5-one (CAS 97051-27-9), with molecular formula C11H8N2OS and molecular weight 216.03574 g/mol. IUPAC: 5-phenyl-3-prop-2-ynyl-1,3,4-thiadiazol-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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2-Phenyl-4-propargyl-1,3,4-thiadiazolin-5-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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