Ethyl 3-{3-[2-(methylsulfanyl)phenyl]propanoyl}benzoate
[CAS# 898754-42-2]

Identification

• Name: Ethyl 3-{3-[2-(methylsulfanyl)phenyl]propanoyl}benzoate
• Synonyms: 3'-carboethoxy-3-(2-thiomethylphenyl)propiophenone
• Molecular Formula: C₁₉H₂₀O₃S
• Molecular Weight: 328.43
• CAS Registry Number: 898754-42-2
• SMILES: CSc2ccccc2CCC(=O)c1cccc(c1)C(=O)OCC
• InChI: 1S/C19H20O3S/c1-3-22-19(21)16-9-6-8-15(13-16)17(20)12-11-14-7-4-5-10-18(14)23-2/h4-10,13H,3,11-12H2,1-2H3
• InChIKey: OCYIFCMOAVBNGY-UHFFFAOYSA-N

Properties

• Density: 1.182g/cm³ (Cal.)
• Boiling point: 491.145°C at 760 mmHg (Cal.)
• Flash point: 242.928°C (Cal.)
• Refractive index: 1.59 (Cal.)