Ethyl 3-[3-(3,4,5-trifluorophenyl)propanoyl]benzoate
[CAS# 898777-78-1]

Identification

• Name: Ethyl 3-[3-(3,4,5-trifluorophenyl)propanoyl]benzoate
• Synonyms: 3'-carboethoxy-3-(3,4,5-trifluorophenyl)propiophenone
• Molecular Formula: C₁₈H₁₅F₃O₃
• Molecular Weight: 336.31
• CAS Registry Number: 898777-78-1
• SMILES: Fc2cc(CCC(=O)c1cccc(c1)C(=O)OCC)cc(F)c2F
• InChI: 1S/C18H15F3O3/c1-2-24-18(23)13-5-3-4-12(10-13)16(22)7-6-11-8-14(19)17(21)15(20)9-11/h3-5,8-10H,2,6-7H2,1H3
• InChIKey: HMOVKYZXKONECE-UHFFFAOYSA-N

Properties

• Density: 1.268g/cm³ (Cal.)
• Boiling point: 441.875°C at 760 mmHg (Cal.)
• Flash point: 213.201°C (Cal.)
• Refractive index: 1.528 (Cal.)