1-[[5-(4-Pyridinyl)-1H-1,2,4-Triazol-3-Yl]Thio]-2-Propanone
[CAS# 67465-03-6]

Identification

• Name: 1-[[5-(4-Pyridinyl)-1H-1,2,4-Triazol-3-Yl]Thio]-2-Propanone
• Synonyms: 1-[[5-(4-Pyridyl)-1H-1,2,4-Triazol-3-Yl]Sulfanyl]Propan-2-One; 1-[[5-(4-Pyridyl)-1H-1,2,4-Triazol-3-Yl]Thio]Propan-2-One; 1-[[5-(4-Pyridyl)-1H-1,2,4-Triazol-3-Yl]Thio]Acetone
• Molecular Formula: C₁₀H₁₀N₄OS
• Molecular Weight: 234.28
• CAS Registry Number: 67465-03-6
• SMILES: C1=CC(=CC=N1)C2=NC(=N[NH]2)SCC(C)=O
• InChI: 1S/C10H10N4OS/c1-7(15)6-16-10-12-9(13-14-10)8-2-4-11-5-3-8/h2-5H,6H2,1H3,(H,12,13,14)
• InChIKey: ZNGITIZOGUCWOQ-UHFFFAOYSA-N

Properties

• Density: 1.389g/cm³ (Cal.)
• Boiling point: 488.481°C at 760 mmHg (Cal.)
• Flash point: 249.224°C (Cal.)