2-(2-Thienyl)-1-(4H-1,2,4-Triazol-4-Yl)Ethanone
[CAS# 443676-57-1]

Identification

• Name: 2-(2-Thienyl)-1-(4H-1,2,4-Triazol-4-Yl)Ethanone
• Synonyms: 2-(thiophen-2-yl)-1-(4H-1,2,4-triazol-4-yl)ethanone
• Molecular Formula: C₈H₇N₃OS
• Molecular Weight: 193.23
• CAS Registry Number: 443676-57-1
• SMILES: c1cc(sc1)CC(=O)n2cnnc2
• InChI: 1S/C8H7N3OS/c12-8(11-5-9-10-6-11)4-7-2-1-3-13-7/h1-3,5-6H,4H2
• InChIKey: QSHDTWXTULWXDE-UHFFFAOYSA-N

Properties

• Density: 1.418g/cm³ (Cal.)
• Boiling point: 382.72°C at 760 mmHg (Cal.)
• Flash point: 185.263°C (Cal.)
• Refractive index: 1.706 (Cal.)