3,3-Bis(Methylsulfanyl)-1-(M-Tolyl)Prop-2-En-1-One
[CAS# 139057-16-2]

Identification

• Name: 3,3-Bis(Methylsulfanyl)-1-(M-Tolyl)Prop-2-En-1-One
• Synonyms: 1-(3-methylphenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one
• Molecular Formula: C₁₂H₁₄OS₂
• Molecular Weight: 238.37
• CAS Registry Number: 139057-16-2
• SMILES: O=C(\C=C(/SC)SC)c1cccc(C)c1
• InChI: 1S/C12H14OS2/c1-9-5-4-6-10(7-9)11(13)8-12(14-2)15-3/h4-8H,1-3H3
• InChIKey: XQBYFCNURYSNJE-UHFFFAOYSA-N

Properties

• Density: 1.145g/cm³ (Cal.)
• Boiling point: 365.155°C at 760 mmHg (Cal.)
• Flash point: 155.03°C (Cal.)
• Refractive index: 1.597 (Cal.)