3-(4-Chlorophenyl)-1-[2-(methylsulfanyl)phenyl]-1-propanone
[CAS# 898787-79-6]

Identification

• Name: 3-(4-Chlorophenyl)-1-[2-(methylsulfanyl)phenyl]-1-propanone
• Synonyms: 3-(4-chlorophenyl)-2'-thiomethylpropiophenone
• Molecular Formula: C₁₆H₁₅ClOS
• Molecular Weight: 290.81
• CAS Registry Number: 898787-79-6
• SMILES: Clc2ccc(CCC(=O)c1ccccc1SC)cc2
• InChI: 1S/C16H15ClOS/c1-19-16-5-3-2-4-14(16)15(18)11-8-12-6-9-13(17)10-7-12/h2-7,9-10H,8,11H2,1H3
• InChIKey: LCQPLOSNALVIIW-UHFFFAOYSA-N

Properties

• Density: 1.224g/cm³ (Cal.)
• Boiling point: 434.534°C at 760 mmHg (Cal.)
• Flash point: 216.599°C (Cal.)
• Refractive index: 1.615 (Cal.)