Ethyl 4-[3,5-bis(trifluoromethyl)phenyl]-4-oxobutanoate
[CAS# 898792-91-1]

Identification

• Name: Ethyl 4-[3,5-bis(trifluoromethyl)phenyl]-4-oxobutanoate
• Synonyms: Ethyl 4-(3,5-ditrifluoromethylphenyl)-4-oxobutyrate
• Molecular Formula: C₁₄H₁₂F₆O₃
• Molecular Weight: 342.23
• CAS Registry Number: 898792-91-1
• SMILES: FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)CCC(=O)OCC
• InChI: 1S/C14H12F6O3/c1-2-23-12(22)4-3-11(21)8-5-9(13(15,16)17)7-10(6-8)14(18,19)20/h5-7H,2-4H2,1H3
• InChIKey: DCTDVDJDNQPXFQ-UHFFFAOYSA-N

Properties

• Density: 1.329g/cm³ (Cal.)
• Boiling point: 297.108°C at 760 mmHg (Cal.)
• Flash point: 129.28°C (Cal.)
• Refractive index: 1.43 (Cal.)