Identification Chemical Properties Supplier

955959-91-8

Name BFRDPA
CAS 955959-91-8
Molecular Formula C36H23NO2
Molecular Weight 501.57
MOL File 955959-91-8.mol
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Chemical Properties

Boiling point  727.2±55.0 °C(Predicted)
density  1.292±0.06 g/cm3(Predicted)
pka 0.34±0.50(Predicted)
InChI InChI=1S/C36H23NO2/c1-3-13-33-29(7-1)31-11-5-9-27(35(31)38-33)23-15-19-25(20-16-23)37-26-21-17-24(18-22-26)28-10-6-12-32-30-8-2-4-14-34(30)39-36(28)32/h1-22,37H
InChIKey DOFCFQWRYGGAKK-UHFFFAOYSA-N
SMILES C1(NC2=CC=C(C3=C4C(=CC=C3)C3=CC=CC=C3O4)C=C2)=CC=C(C2=C3C(=CC=C2)C2=CC=CC=C2O3)C=C1

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