1-(3-Phenyl-2-propyn-1-yl)-4-thioxo-2-azetidinone
[CAS# 82393-83-7]

Identification

• Name: 1-(3-Phenyl-2-propyn-1-yl)-4-thioxo-2-azetidinone
• Synonyms: 1-(3-phenylprop-2-yn-1-yl)-4-thioxoazetidin-2-one
• Molecular Formula: C₁₂H₉NOS
• Molecular Weight: 215.27
• CAS Registry Number: 82393-83-7
• SMILES: O=C2CC(=S)N2CC#Cc1ccccc1
• InChI: 1S/C12H9NOS/c14-11-9-12(15)13(11)8-4-7-10-5-2-1-3-6-10/h1-3,5-6H,8-9H2
• InChIKey: UVKXLIIUUHOGFC-UHFFFAOYSA-N

Properties

• Density: 1.328g/cm³ (Cal.)
• Boiling point: 345.042°C at 760 mmHg (Cal.)
• Flash point: 162.476°C (Cal.)