68054-73-9

Name 2,5-Cyclohexadiene-1,4-dione, 2-[(1-methylethyl)amino]-5-(phenylamino)-
CAS 68054-73-9
Molecular Formula C15H16N2O2
Molecular Weight 256.3
MOL File 68054-73-9.mol
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Chemical Properties

Melting point  206 °C(Solv: ethanol (64-17-5))
Boiling point  412.1±45.0 °C(Predicted)
density  1.18±0.1 g/cm3(Predicted)
solubility  Acetonitrile: Slightly soluble: 0.1-1 mg/ml
DMSO: Sparingly soluble: 1- 10 mg/ml
pka 0.87±0.20(Predicted)
InChI InChI=1S/C15H16N2O2/c1-10(2)16-12-8-15(19)13(9-14(12)18)17-11-6-4-3-5-7-11/h3-10,16-17H,1-2H3
InChIKey ZQAFKGDWLSVTRI-UHFFFAOYSA-N
SMILES C1(=O)C=C(NC2=CC=CC=C2)C(=O)C=C1NC(C)C

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