1-(3-Methyl-5-Thioxo-1,5-Dihydro-4H-1,2,4-Triazol-4-Yl)Ethanone
[CAS# 149747-26-2]

Identification

• Name: 1-(3-Methyl-5-Thioxo-1,5-Dihydro-4H-1,2,4-Triazol-4-Yl)Ethanone
• Synonyms: 1-(3-methyl-5-thioxo-1H-1,2,4-triazol-4(5H)-yl)ethanone
• Molecular Formula: C₅H₇N₃OS
• Molecular Weight: 157.19
• CAS Registry Number: 149747-26-2
• SMILES: CC1=NNC(=S)N1C(=O)C
• InChI: 1S/C5H7N3OS/c1-3-6-7-5(10)8(3)4(2)9/h1-2H3,(H,7,10)
• InChIKey: PEHFAUMBQVZYEG-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 209.3±23.0°C at 760 mmHg (Cal.)
• Flash point: 80.4±22.6°C (Cal.)
• Refractive index: 1.676 (Cal.)