5-Methyl-4-(2-Propyn-1-Ylsulfanyl)-1,2-Oxazol-3(2H)-One
[CAS# 271787-03-2]

Identification

• Name: 5-Methyl-4-(2-Propyn-1-Ylsulfanyl)-1,2-Oxazol-3(2H)-One
• Synonyms: 5-methyl-4-(prop-2-yn-1-ylthio)isoxazol-3(2H)-one
• Molecular Formula: C₇H₇NO₂S
• Molecular Weight: 169.20
• CAS Registry Number: 271787-03-2
• SMILES: O=C1C(/SCC#C)=C(\ON1)C
• InChI: 1S/C7H7NO2S/c1-3-4-11-6-5(2)10-8-7(6)9/h1H,4H2,2H3,(H,8,9)
• InChIKey: MKYZVCPCNCKBBE-UHFFFAOYSA-N

Properties

• Density: 1.311g/cm³ (Cal.)
• Refractive index: 1.584 (Cal.)