1-Amino-2-[P-[(Hexahydro-2-Oxo-1H-Azepin-1-Yl)Methyl]Phenoxy]-4-Hydroxyanthraquinone
[CAS# 19014-53-0]

Identification

• Name: 1-Amino-2-[P-[(Hexahydro-2-Oxo-1H-Azepin-1-Yl)Methyl]Phenoxy]-4-Hydroxyanthraquinone
• Synonyms: 1-Amino-4-Hydroxy-2-[4-[(2-Oxo-1-Azepanyl)Methyl]Phenoxy]Anthracene-9,10-Dione; 1-Amino-4-Hydroxy-2-[4-[(2-Ketoazepan-1-Yl)Methyl]Phenoxy]-9,10-Anthraquinone; 9,10-Anthracenedione, 1-Amino-2-(4-((Hexahydro-2-Oxo-1H-Azepin-1-Yl)Methyl)Phenoxy)-4-Hydroxy-
• Molecular Formula: C₂₇H₂₄N₂O₅
• Molecular Weight: 456.50
• CAS Registry Number: 19014-53-0
• EINECS: 242-756-6
• SMILES: C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C(=CC(=C3N)OC4=CC=C(C=C4)CN5C(=O)CCCCC5)O
• InChI: 1S/C27H24N2O5/c28-25-21(14-20(30)23-24(25)27(33)19-7-4-3-6-18(19)26(23)32)34-17-11-9-16(10-12-17)15-29-13-5-1-2-8-22(29)31/h3-4,6-7,9-12,14,30H,1-2,5,8,13,15,28H2
• InChIKey: MUABDJUHEPDWHI-UHFFFAOYSA-N

Properties

• Density: 1.379g/cm³ (Cal.)
• Boiling point: 729.35°C at 760 mmHg (Cal.)
• Flash point: 394.897°C (Cal.)