1,4-Diamino-2-Bromo-5-Nitroanthraquinone
[CAS# 68516-55-2]

Identification

• Name: 1,4-Diamino-2-Bromo-5-Nitroanthraquinone
• Synonyms: 1,4-Diamino-2-Bromo-5-Nitro-Anthracene-9,10-Dione; 1,4-Diamino-2-Bromo-5-Nitro-9,10-Anthraquinone; 2-Bromo-9,10-Dihydro-5-Nitro-9,10-Dioxo-1,4-Diaminoanthracene
• Molecular Formula: C₁₄H₈BrN₃O₄
• Molecular Weight: 362.14
• CAS Registry Number: 68516-55-2
• EINECS: 271-160-9
• SMILES: C1=C(N)C2=C(C(=C1Br)N)C(=O)C3=C(C2=O)C(=CC=C3)[N+]([O-])=O
• InChI: 1S/C14H8BrN3O4/c15-6-4-7(16)10-11(12(6)17)13(19)5-2-1-3-8(18(21)22)9(5)14(10)20/h1-4H,16-17H2
• InChIKey: XSTBDPPWAZQHLQ-UHFFFAOYSA-N

Properties

• Density: 1.89g/cm³ (Cal.)
• Boiling point: 671.974°C at 760 mmHg (Cal.)
• Flash point: 360.197°C (Cal.)