1-(3,5-Dichlorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
[CAS# 898781-75-4]

Identification

• Name: 1-(3,5-Dichlorophenyl)-3-[4-(methylsulfanyl)phenyl]-1-propanone
• Synonyms: 3',5'-dichloro-3-(4-thiomethylphenyl)propiophenone
• Molecular Formula: C₁₆H₁₄Cl₂OS
• Molecular Weight: 325.25
• CAS Registry Number: 898781-75-4
• SMILES: Clc1cc(cc(Cl)c1)C(=O)CCc2ccc(SC)cc2
• InChI: 1S/C16H14Cl2OS/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: VBBABOBQUZOVDD-UHFFFAOYSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 475.886°C at 760 mmHg (Cal.)
• Flash point: 241.607°C (Cal.)
• Refractive index: 1.624 (Cal.)