N-Ethyl-9-oxo-2,4,6,8-tetrakis(p-chlorophenyl)-3,7-diazabicyclo(3.3.1)nonane-3-carboxamide
[CAS# 82058-43-3]

Identification

• Name: N-Ethyl-9-oxo-2,4,6,8-tetrakis(p-chlorophenyl)-3,7-diazabicyclo(3.3.1)nonane-3-carboxamide
• Synonyms: 2,4,6,8-Tetrakis(4-Chlorophenyl)-N-Ethyl-9-Keto-3,7-Diazabicyclo[3.3.1]Nonane-7-Carboxamide; Ita 476; N-Ethyl-9-Oxo-2,4,6,8-Tetrakis(P-Chlorophenyl)-3,7-Diazabicyclo(3.3.1)Nonane-3-Carboxamide
• Molecular Formula: C₃₄H₂₉Cl₄N₃O₂
• Molecular Weight: 653.43
• CAS Registry Number: 82058-43-3
• SMILES: C1=CC(=CC=C1C3C2C(NC(C(C2=O)C(N3C(NCC)=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl)Cl
• InChI: 1S/C34H29Cl4N3O2/c1-2-39-34(43)41-31(21-7-15-25(37)16-8-21)27-29(19-3-11-23(35)12-4-19)40-30(20-5-13-24(36)14-6-20)28(33(27)42)32(41)22-9-17-26(38)18-10-22/h3-18,27-32,40H,2H2,1H3,(H,39,43)
• InChIKey: KSSKVLAGUBUECK-UHFFFAOYSA-N

Properties

• Density: 1.346g/cm³ (Cal.)
• Boiling point: 774.086°C at 760 mmHg (Cal.)
• Flash point: 421.952°C (Cal.)