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Hexaazatriphenylenehexacabonitrile Structure

Hexaazatriphenylenehexacabonitrile

Chemical Properties

Melting point >500°C
Boiling point 988.7±65.0 °C(Predicted)
Density  1.86
refractive index  n/550 1.81
storage temp.  Inert atmosphere,Room Temperature
solubility  acetone: soluble
acetonitrile: soluble
methylene chloride: soluble
form  powder or crystals
pka -22.82±0.50(Predicted)
color  Dark yellow
semiconductor properties (mobility=0.1-1cm2/V·s) (electron mobility)
λmax 282-321 nm in methylene chloride (PL: 422 nm)
InChI InChI=1S/C18N12/c19-1-7-8(2-20)26-14-13(25-7)15-17(29-10(4-22)9(3-21)27-15)18-16(14)28-11(5-23)12(6-24)30-18
InChIKey DKHNGUNXLDCATP-UHFFFAOYSA-N
SMILES N1C2C(=C3N=C(C#N)C(C#N)=NC3=C3N=C(C#N)C(C#N)=NC3=2)N=C(C#N)C=1C#N
Absorption λmax282, 321 nm (inCH2Cl2)

Safety Information

WGK Germany  3
HS Code  2933998090
Storage Class 11 - Combustible Solids

Usage And Synthesis

Preparation Products And Raw materials

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