1-[1-(2-Methyl-2-propanyl)-1H-1,2,3-triazol-4-yl]ethanone
[CAS# 98013-37-7]

Identification

• Name: 1-[1-(2-Methyl-2-propanyl)-1H-1,2,3-triazol-4-yl]ethanone
• Synonyms: 1-(1-(tert-butyl)-1H-1,2,3-triazol-4-yl)ethanone
• Molecular Formula: C₈H₁₃N₃O
• Molecular Weight: 167.21
• CAS Registry Number: 98013-37-7
• SMILES: O=C(C)c1cn(nn1)C(C)(C)C
• InChI: 1S/C8H13N3O/c1-6(12)7-5-11(10-9-7)8(2,3)4/h5H,1-4H3
• InChIKey: SYAYAYOPDSNOCA-UHFFFAOYSA-N

Properties

• Density: 1.099g/cm³ (Cal.)
• Boiling point: 269.752°C at 760 mmHg (Cal.)
• Flash point: 116.942°C (Cal.)