1-(2,5-Dichlorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
[CAS# 898781-71-0]

Identification

• Name: 1-(2,5-Dichlorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
• Synonyms: 2',5'-dichloro-3-(4-thiomethylphenyl)propiophenone
• Molecular Formula: C₁₆H₁₄Cl₂OS
• Molecular Weight: 325.25
• CAS Registry Number: 898781-71-0
• SMILES: O=C(CCc1ccc(SC)cc1)c2cc(Cl)ccc2Cl
• InChI: 1S/C16H14Cl2OS/c1-20-13-6-2-11(3-7-13)4-9-16(19)14-10-12(17)5-8-15(14)18/h2-3,5-8,10H,4,9H2,1H3
• InChIKey: OODNHEFJGPHFIX-UHFFFAOYSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 458.519°C at 760 mmHg (Cal.)
• Flash point: 231.104°C (Cal.)
• Refractive index: 1.624 (Cal.)