1,5-Diamino-4,8-Dihydroxy-2-(Hydroxytolyl)Anthraquinone
[CAS# 68310-48-5]

Identification

• Name: 1,5-Diamino-4,8-Dihydroxy-2-(Hydroxytolyl)Anthraquinone
• Synonyms: 1,5-Diamino-4,8-Dihydroxy-2-(4-Methylolphenyl)-9,10-Anthraquinone; 9,10-Anthracenedione, 1,5-Diamino-4,8-Dihydroxy-2-(Hydroxymethylphenyl)-; Disperse Blue 127
• Molecular Formula: C₂₁H₁₆N₂O₅
• Molecular Weight: 376.37
• CAS Registry Number: 68310-48-5
• EINECS: 269-715-5
• SMILES: C1=C(C(=C3C(=C1O)C(C2=C(C=CC(=C2C3=O)O)N)=O)N)C4=CC=C(C=C4)CO
• InChI: 1S/C21H16N2O5/c22-12-5-6-13(25)16-15(12)20(27)17-14(26)7-11(19(23)18(17)21(16)28)10-3-1-9(8-24)2-4-10/h1-7,24-26H,8,22-23H2
• InChIKey: VBPUGATXVPUONO-UHFFFAOYSA-N

Properties

• Density: 1.571g/cm³ (Cal.)
• Boiling point: 775.772°C at 760 mmHg (Cal.)
• Flash point: 422.972°C (Cal.)