1-(3-Methyl-5-Thioxo-4,5-Dihydro-1H-Pyrazol-4-Yl)Ethanone
[CAS# 211988-12-4]

Identification

• Name: 1-(3-Methyl-5-Thioxo-4,5-Dihydro-1H-Pyrazol-4-Yl)Ethanone
• Synonyms: 1-(3-methyl-5-thioxo-4,5-dihydro-1H-pyrazol-4-yl)ethanone
• Molecular Formula: C₆H₈N₂OS
• Molecular Weight: 156.21
• CAS Registry Number: 211988-12-4
• SMILES: CC1=NNC(=S)C1C(=O)C
• InChI: 1S/C6H8N2OS/c1-3-5(4(2)9)6(10)8-7-3/h5H,1-2H3,(H,8,10)
• InChIKey: VKDONQZOYFRWLK-UHFFFAOYSA-N

Properties

• Density: 1.369g/cm³ (Cal.)
• Boiling point: 247.237°C at 760 mmHg (Cal.)
• Flash point: 103.325°C (Cal.)
• Refractive index: 1.649 (Cal.)