1-Benzoyl-4-(4-(1,1-Dimethylpropyl)Phenoxy)-6-(Phenylamino)-3H-Dibenz(f,ij)Isoquinoline-2,7-Dione
[CAS# 72453-58-8]

Identification

• Name: 1-Benzoyl-4-(4-(1,1-Dimethylpropyl)Phenoxy)-6-(Phenylamino)-3H-Dibenz(f,ij)Isoquinoline-2,7-Dione
• Synonyms: 1-Benzoyl-4-(4-(1,1-Dimethylpropyl)Phenoxy)-6-(Phenylamino)-3H-Dibenz(F,I,J)Isoquinoline-2,7-Dione
• Molecular Formula: C₄₀H₃₂N₂O₄
• Molecular Weight: 604.70
• CAS Registry Number: 72453-58-8
• SMILES: C3=C(NC1=CC=CC=C1)C7=C2C(=C(C(=O)NC2=C3OC4=CC=C(C(CC)(C)C)C=C4)C(=O)C5=CC=CC=C5)C6=CC=CC=C6C7=O
• InChI: 1S/C40H32N2O4/c1-4-40(2,3)25-19-21-27(22-20-25)46-31-23-30(41-26-15-9-6-10-16-26)33-34-32(28-17-11-12-18-29(28)38(33)44)35(39(45)42-36(31)34)37(43)24-13-7-5-8-14-24/h5-23,41H,4H2,1-3H3,(H,42,45)
• InChIKey: QUTLRBYOTJDTQY-UHFFFAOYSA-N

Properties

• Density: 1.334g/cm³ (Cal.)
• Boiling point: 764.981°C at 760 mmHg (Cal.)
• Flash point: 416.446°C (Cal.)