Triphenyl [(2,4,6-Trioxo-1,3,5-Triazinane-1,3,5-Triyl)Tris(6-Methyl-3,1-Phenylene)]Triscarbamate
[CAS# 28888-79-1]

Identification

• Name: Triphenyl [(2,4,6-Trioxo-1,3,5-Triazinane-1,3,5-Triyl)Tris(6-Methyl-3,1-Phenylene)]Triscarbamate
• Synonyms: triphenyl [(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris(6-methyl-3,1-phenylene)]tricarbamate
• Molecular Formula: C₄₅H₃₆N₆O₉
• Molecular Weight: 804.80
• CAS Registry Number: 28888-79-1
• EINECS: 249-289-7
• SMILES: O=C(Oc1ccccc1)Nc2cc(ccc2C)N5C(=O)N(c4ccc(C)c(NC(=O)Oc3ccccc3)c4)C(=O)N(C5=O)c7cc(NC(=O)Oc6ccccc6)c(C)cc7
• InChI: 1S/C45H36N6O9/c1-28-19-22-31(25-37(28)46-40(52)58-34-13-7-4-8-14-34)49-43(55)50(32-23-20-29(2)38(26-32)47-41(53)59-35-15-9-5-10-16-35)45(57)51(44(49)56)33-24-21-30(3)39(27-33)48-42(54)60-36-17-11-6-12-18-36/h4-27H,1-3H3,(H,46,52)(H,47,53)(H,48,54)
• InChIKey: HIVSYBQYXIMMGH-UHFFFAOYSA-N

Properties

• Density: 1.423g/cm³ (Cal.)
• Boiling point: 894.625°C at 760 mmHg (Cal.)
• Flash point: 494.852°C (Cal.)
• Refractive index: 1.707 (Cal.)