5-[(1-Ethyl-5-methyl-1H-1,2,4-triazol-3-yl)methyl]-1,3,4-oxadiazole-2(3H)-thione
[CAS# 817568-84-6]

Identification

• Name: 5-[(1-Ethyl-5-methyl-1H-1,2,4-triazol-3-yl)methyl]-1,3,4-oxadiazole-2(3H)-thione
• Synonyms: 5-((1-ethyl-5-methyl-1H-1,2,4-triazol-3-yl)methyl)-1,3,4-oxadiazole-2(3H)-thione; 5-(1-Ethyl-5-methyl-1H-[1,2,4]triazol-3-ylmethyl)-3H-[1,3,4]oxadiazole-2-thione; AIDS224164
• Molecular Formula: C₈H₁₁N₅OS
• Molecular Weight: 225.27
• CAS Registry Number: 817568-84-6
• SMILES: S=C1O\C(=N/N1)Cc2nn(c(n2)C)CC
• InChI: 1S/C8H11N5OS/c1-3-13-5(2)9-6(12-13)4-7-10-11-8(15)14-7/h3-4H2,1-2H3,(H,11,15)
• InChIKey: NVPYEPMJUAIUAV-UHFFFAOYSA-N

Properties

• Density: 1.528g/cm³ (Cal.)
• Boiling point: 377.678°C at 760 mmHg (Cal.)
• Flash point: 182.214°C (Cal.)
• Refractive index: 1.73 (Cal.)