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AOH1996 Structure

AOH1996

Chemical Properties

Boiling point 703.9±50.0 °C(Predicted)
Density  1.269±0.06 g/cm3(Predicted)
solubility  Chloroform: Soluble
Ethanol: Soluble
Methanol: Soluble
pka 12.87±0.70(Predicted)
InChI InChI=1S/C26H22N2O4/c1-31-19-10-7-11-20(16-19)32-24-15-5-4-14-23(24)28-25(29)17-27-26(30)22-13-6-9-18-8-2-3-12-21(18)22/h2-16H,17H2,1H3,(H,27,30)(H,28,29)
InChIKey HDMONPHKMIZXDH-UHFFFAOYSA-N
SMILES C1(C(NCC(NC2=CC=CC=C2OC2=CC=CC(OC)=C2)=O)=O)=C2C(C=CC=C2)=CC=C1

Usage And Synthesis

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