Dodecahydro-N,N',N''-Triphenyl-1,4,7,9b-Tetraazaphenalene-1,4,7-Tricarboxamide
[CAS# 10553-79-4]

Identification

• Name: Dodecahydro-N,N',N''-Triphenyl-1,4,7,9b-Tetraazaphenalene-1,4,7-Tricarboxamide
• Synonyms: Tetraazaphenalene-Tricarboxanilide Der.; 1,4,7,9B-Tetraazaphenalene-1,4,7(2H,5H,8H)-Tricarboxanilide, 3,3A,6,6A,9,9A-Hexahydro-; Nsc202441
• Molecular Formula: C₃₀H₃₃N₇O₃
• Molecular Weight: 539.64
• CAS Registry Number: 10553-79-4
• SMILES: C6=C(NC(=O)N5C2N1C(N(CCC1N(CC2)C(=O)NC3=CC=CC=C3)C(=O)NC4=CC=CC=C4)CC5)C=CC=C6
• InChI: 1S/C30H33N7O3/c38-28(31-22-10-4-1-5-11-22)34-19-16-26-36(30(40)33-24-14-8-3-9-15-24)21-18-27-35(20-17-25(34)37(26)27)29(39)32-23-12-6-2-7-13-23/h1-15,25-27H,16-21H2,(H,31,38)(H,32,39)(H,33,40)
• InChIKey: KZABVRNPOUFTLG-UHFFFAOYSA-N

Properties

• Density: 1.391g/cm³ (Cal.)
• Boiling point: 870.102°C at 760 mmHg (Cal.)
• Flash point: 480.021°C (Cal.)