Ethyl 3-{4-[(trifluoromethyl)sulfanyl]phenyl}propanoate
[CAS# 910654-45-4]

Identification

• Name: Ethyl 3-{4-[(trifluoromethyl)sulfanyl]phenyl}propanoate
• Synonyms: 3-(4-Trifluoromethylsulfanyl-phenyl)-propionic aci; ethyl 3-{4-[(trifluoromethyl)sulfanyl]phenyl}propanoate
• Molecular Formula: C₁₂H₁₃F₃O₂S
• Molecular Weight: 278.29
• CAS Registry Number: 910654-45-4
• SMILES: CCOC(=O)CCc1ccc(cc1)SC(F)(F)F
• InChI: 1S/C12H13F3O2S/c1-2-17-11(16)8-5-9-3-6-10(7-4-9)18-12(13,14)15/h3-4,6-7H,2,5,8H2,1H3
• InChIKey: WKKZSSRKIYKWET-UHFFFAOYSA-N

Properties

• Density: 1.257g/cm³ (Cal.)
• Boiling point: 259.097°C at 760 mmHg (Cal.)
• Flash point: 110.498°C (Cal.)
• Refractive index: 1.497 (Cal.)