1-{[5-(2-Pyridinylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetone
[CAS# 606117-18-4]

Identification

• Name: 1-{[5-(2-Pyridinylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetone
• Synonyms: 1-((5-(pyridin-2-ylmethyl)-1,3,4-oxadiazol-2-yl)thio)propan-2-one
• Molecular Formula: C₁₁H₁₁N₃O₂S
• Molecular Weight: 249.29
• CAS Registry Number: 606117-18-4
• SMILES: O=C(CSc1nnc(o1)Cc2ncccc2)C
• InChI: 1S/C11H11N3O2S/c1-8(15)7-17-11-14-13-10(16-11)6-9-4-2-3-5-12-9/h2-5H,6-7H2,1H3
• InChIKey: UIRODHLNQWEFMG-UHFFFAOYSA-N

Properties

• Density: 1.329g/cm³ (Cal.)
• Boiling point: 423.378°C at 760 mmHg (Cal.)
• Flash point: 209.852°C (Cal.)
• Refractive index: 1.598 (Cal.)