1-(3-Chloro-5-fluorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
[CAS# 898781-63-0]

Identification

• Name: 1-(3-Chloro-5-fluorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
• Synonyms: 3'-chloro-5'-fluoro-3-(4-thiomethylphenyl)propiophenone
• Molecular Formula: C₁₆H₁₄ClFOS
• Molecular Weight: 308.80
• CAS Registry Number: 898781-63-0
• SMILES: Fc1cc(cc(Cl)c1)C(=O)CCc2ccc(SC)cc2
• InChI: 1S/C16H14ClFOS/c1-20-15-5-2-11(3-6-15)4-7-16(19)12-8-13(17)10-14(18)9-12/h2-3,5-6,8-10H,4,7H2,1H3
• InChIKey: IBTUIWKAJMVYOL-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.)