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5-Amino-N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxamide Structure

5-Amino-N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxamide

Chemical Properties

Melting point 195°C (dec.)
Boiling point 684.9±55.0 °C(Predicted)
Density  2.386±0.06 g/cm3(Predicted)
vapor pressure  0Pa at 25℃
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  DMSO (Slightly, Heated), Methanol (Slightly)
pka 11.58±0.46(Predicted)
color  White to Off-White
Stability Hygroscopic
Major Application pharmaceutical
InChI InChI=1S/C14H18I3N3O6/c15-9-7(13(25)19-1-5(23)3-21)10(16)12(18)11(17)8(9)14(26)20-2-6(24)4-22/h5-6,21-24H,1-4,18H2,(H,19,25)(H,20,26)
InChIKey KAEGSAWWVYMWIQ-UHFFFAOYSA-N
SMILES C1(C(NCC(O)CO)=O)=C(I)C(N)=C(I)C(C(NCC(O)CO)=O)=C1I
LogP -1.81 at 23℃ and pH5.83
Surface tension 72.85mN/m at 1g/L and 20℃
CAS DataBase Reference 76801-93-9(CAS DataBase Reference)

Safety Information

WGK Germany  WGK 3
HS Code  2924296000
Storage Class 11 - Combustible Solids

Usage And Synthesis

Preparation Products And Raw materials

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