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9,10-Dioxo Ketotifen Structure

9,10-Dioxo Ketotifen

Chemical Properties

Melting point 200-201 °C (decomp)
Boiling point 505.7±50.0 °C(Predicted)
Density  1.310±0.06 g/cm3(Predicted)
storage temp.  Amber Vial, -20°C Freezer, Under Inert Atmosphere
solubility  Chloroform (Slightly), DMSO (Slightly)
pka 8.67±0.20(Predicted)
color  Yellow
Stability Light sensitive
Major Application pharmaceutical (small molecule)
InChI 1S/C19H17NO2S/c1-20-9-6-12(7-10-20)16-13-4-2-3-5-14(13)17(21)18(22)19-15(16)8-11-23-19/h2-5,8,11H,6-7,9-10H2,1H3
InChIKey SEWPKRUDHMXTMH-UHFFFAOYSA-N
SMILES [s]1c2c(cc1)C(=C4CCN(CC4)C)c3c(cccc3)C(=O)C2=O

Safety Information

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Usage And Synthesis

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