PRODUCT Properties
| Melting point: | 168-169 °C |
| Boiling point: | 388.3±21.0 °C(Predicted) |
| Density | 1.134±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly, Heated) |
| form | solid |
| pka | 4.34±0.10(Predicted) |
| color | White to off-white |
| Major Application | pharmaceutical small molecule |
| InChI | 1S/C15H14O2/c1-11(15(16)17)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-11H,1H3,(H,16,17) |
| InChIKey | JALUUBQFLPUJMY-UHFFFAOYSA-N |
| SMILES | OC(=O)C(C)c1ccc(cc1)c2ccccc2 |
Description and Uses
A metabolite of Isopropylbiphenyl, a COX-2 selective inhibitor. Also an impurity of Flurbiprofen (F598700).
Safety
| Symbol(GHS) | ![]() GHS06 |
| Signal word | Danger |
| Hazard statements | H301 |
| Precautionary statements | P264-P270-P301+P310-P405-P501 |
| RIDADR | UN 2811 6.1 / PGIII |
| WGK Germany | WGK 3 |
| HS Code | 2916399000 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral |






![1-(2-fluoro-[1,1''-biphenyl]-4-yl)ethan-1-one](https://img.chemicalbook.com/CAS/GIF/42771-79-9.gif)
