1,4-Dihydro-4-[3-(phenylamidinoamidino)imino]-N,N-1-tris(phenylamidinoamidino)-2,6-Pyridinedicarboxamide
[CAS# 74050-92-3]

Identification

• Name: 1,4-Dihydro-4-[3-(phenylamidinoamidino)imino]-N,N-1-tris(phenylamidinoamidino)-2,6-Pyridinedicarboxamide
• Synonyms: Brn 0383415; 2,6-Pyridinedicarboxamide, 1,4-Dihydro-4-(3-Phenylamidinoamidinoimino)-N,N,1-Tris(Phenylamidinoamidino)-; 2,6-Pyridinedicarboxamide, 1,4-Dihydro-N,N',1-Tris(Imino((Imino(Phenylamino)Methyl)Amino)Methyl)-4-((Imino((Imino(Phenylamino)Methyl)Amino)Methyl)Imino)-(9Ci)
• Molecular Formula: C₃₉H₄₀N₂₀O₂
• Molecular Weight: 820.88
• CAS Registry Number: 74050-92-3
• SMILES: C1=CC=CC=C1NC(NC(N=C2C=C(N(C(=C2)C(NC(NC(NC3=CC=CC=C3)=N)=N)=O)C(NC(NC4=CC=CC=C4)=N)=N)C(NC(NC(NC5=CC=CC=C5)=N)=N)=O)=N)=N
• InChI: 1S/C39H40N20O2/c40-32(48-23-13-5-1-6-14-23)55-35(43)52-27-21-28(30(60)53-37(45)56-33(41)49-24-15-7-2-8-16-24)59(39(47)58-36(44)51-26-19-11-4-12-20-26)29(22-27)31(61)54-38(46)57-34(42)50-25-17-9-3-10-18-25/h1-22H,(H4,40,43,48,55)(H4,44,47,51,58)(H5,41,45,49,53,56,60)(H5,42,46,50,54,57,61)
• InChIKey: ZZMNCIGGPDIGKP-UHFFFAOYSA-N

Properties

• Density: 1.5g/cm³ (Cal.)
• Boiling point: 961.4°C at 760 mmHg (Cal.)
• Flash point: 535.3°C (Cal.)