1-(4-Chloro-3-fluorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
[CAS# 898781-42-5]

Identification

• Name: 1-(4-Chloro-3-fluorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
• Synonyms: 4'-chloro-3'-fluoro-3-(4-thiomethylphenyl)propiophenone
• Molecular Formula: C₁₆H₁₄ClFOS
• Molecular Weight: 308.80
• CAS Registry Number: 898781-42-5
• SMILES: Fc1cc(ccc1Cl)C(=O)CCc2ccc(SC)cc2
• InChI: 1S/C16H14ClFOS/c1-20-13-6-2-11(3-7-13)4-9-16(19)12-5-8-14(17)15(18)10-12/h2-3,5-8,10H,4,9H2,1H3
• InChIKey: REXAJTRZSFVYOO-UHFFFAOYSA-N

Properties

• Density: 1.275g/cm³ (Cal.)
• Boiling point: 451.856°C at 760 mmHg (Cal.)
• Flash point: 227.075°C (Cal.)
• Refractive index: 1.601 (Cal.)