3-(4-Chlorophenyl)-1-[4-(methylsulfanyl)phenyl]-1-propanone
[CAS# 898787-82-1]

Identification

• Name: 3-(4-Chlorophenyl)-1-[4-(methylsulfanyl)phenyl]-1-propanone
• Synonyms: 3-(4-chlorophenyl)-4'-thiomethylpropiophenone
• Molecular Formula: C₁₆H₁₅ClOS
• Molecular Weight: 290.81
• CAS Registry Number: 898787-82-1
• SMILES: Clc2ccc(CCC(=O)c1ccc(SC)cc1)cc2
• InChI: 1S/C16H15ClOS/c1-19-15-9-5-13(6-10-15)16(18)11-4-12-2-7-14(17)8-3-12/h2-3,5-10H,4,11H2,1H3
• InChIKey: VFZYSJQBRPRVIA-UHFFFAOYSA-N

Properties

• Density: 1.224g/cm³ (Cal.)
• Boiling point: 448.902°C at 760 mmHg (Cal.)
• Flash point: 225.288°C (Cal.)
• Refractive index: 1.615 (Cal.)