Ethyl 4-[2-Nitro-4-[(1-Oxooctadecyl)Amino]Anilino]Phenyl Carbonate
[CAS# 68715-91-3]

Identification

• Name: Ethyl 4-[2-Nitro-4-[(1-Oxooctadecyl)Amino]Anilino]Phenyl Carbonate
• Synonyms: Carbonic Acid Ethyl [4-[[2-Nitro-4-(1-Oxooctadecylamino)Phenyl]Amino]Phenyl] Ester; Carbonic Acid Ethyl [4-[(2-Nitro-4-Stearamido-Phenyl)Amino]Phenyl] Ester; 2-Nitro-4-Stearamido-4'-Ethoxycarbonyloxydiphenylamine
• Molecular Formula: C₃₃H₄₉N₃O₆
• Molecular Weight: 583.77
• CAS Registry Number: 68715-91-3
• EINECS: 272-107-2
• SMILES: C1=C(C=CC(=C1)NC2=C(C=C(C=C2)NC(=O)CCCCCCCCCCCCCCCCC)[N+]([O-])=O)OC(=O)OCC
• InChI: 1S/C33H49N3O6/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-32(37)35-28-22-25-30(31(26-28)36(39)40)34-27-20-23-29(24-21-27)42-33(38)41-4-2/h20-26,34H,3-19H2,1-2H3,(H,35,37)
• InChIKey: ZKFBNPLIKFKRNO-UHFFFAOYSA-N

Properties

• Density: 1.112g/cm³ (Cal.)
• Boiling point: 698.048°C at 760 mmHg (Cal.)
• Flash point: 375.966°C (Cal.)