1,1,1-Trifluoro-3-(3-iodophenyl)acetone
[CAS# 898787-67-2]

Identification

• Name: 1,1,1-Trifluoro-3-(3-iodophenyl)acetone
• Synonyms: 3-(3-iodophenyl)-1,1,1-trifluoro-2-propanone
• Molecular Formula: C₉H₆F₃IO
• Molecular Weight: 314.04
• CAS Registry Number: 898787-67-2
• SMILES: Ic1cc(CC(=O)C(F)(F)F)ccc1
• InChI: 1S/C9H6F3IO/c10-9(11,12)8(14)5-6-2-1-3-7(13)4-6/h1-4H,5H2
• InChIKey: NQYKYSVHYFFSJC-UHFFFAOYSA-N

Properties

• Density: 1.801g/cm³ (Cal.)
• Boiling point: 269.85°C at 760 mmHg (Cal.)
• Flash point: 117.001°C (Cal.)
• Refractive index: 1.529 (Cal.)