Ethyl 4-[3-(3,4,5-trifluorophenyl)propanoyl]benzoate
[CAS# 898777-80-5]

Identification

• Name: Ethyl 4-[3-(3,4,5-trifluorophenyl)propanoyl]benzoate
• Synonyms: 4'-carboethoxy-3-(3,4,5-trifluorophenyl)propiophenone
• Molecular Formula: C₁₈H₁₅F₃O₃
• Molecular Weight: 336.31
• CAS Registry Number: 898777-80-5
• SMILES: Fc2cc(CCC(=O)c1ccc(cc1)C(=O)OCC)cc(F)c2F
• InChI: 1S/C18H15F3O3/c1-2-24-18(23)13-6-4-12(5-7-13)16(22)8-3-11-9-14(19)17(21)15(20)10-11/h4-7,9-10H,2-3,8H2,1H3
• InChIKey: XNQLYKVLADBXKV-UHFFFAOYSA-N

Properties

• Density: 1.268g/cm³ (Cal.)
• Boiling point: 445.143°C at 760 mmHg (Cal.)
• Flash point: 215.095°C (Cal.)
• Refractive index: 1.528 (Cal.)