1-(3-Methylphenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
[CAS# 898780-77-3]

Identification

• Name: 1-(3-Methylphenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
• Synonyms: 3'-methyl-2-(4-thiomethylphenyl)propiophenone
• Molecular Formula: C₁₇H₁₈OS
• Molecular Weight: 270.39
• CAS Registry Number: 898780-77-3
• SMILES: CSc2ccc(CCC(=O)c1cccc(C)c1)cc2
• InChI: 1S/C17H18OS/c1-13-4-3-5-15(12-13)17(18)11-8-14-6-9-16(19-2)10-7-14/h3-7,9-10,12H,8,11H2,1-2H3
• InChIKey: HZSMEWFOSVEYHX-UHFFFAOYSA-N

Properties

• Density: 1.115g/cm³ (Cal.)
• Boiling point: 435.831°C at 760 mmHg (Cal.)
• Flash point: 240.618°C (Cal.)
• Refractive index: 1.598 (Cal.)