1,6-Dinitro-Benzo(E)Pyrene
[CAS# 120812-48-8]

Identification

• Name: 1,6-Dinitro-Benzo(E)Pyrene
• Synonyms: Ccris 2862; 1,6-Dinitro-Benzo(E)Pyrene; 1,6-Dinitrobenzo(E)Pyrene
• Molecular Formula: C₂₀H₁₀N₂O₄
• Molecular Weight: 342.31
• CAS Registry Number: 120812-48-8
• SMILES: C2=CC3=C1C=CC=CC1=C4C(=CC=C5C=CC(=C2[N+]([O-])=O)C3=C45)[N+]([O-])=O
• InChI: 1S/C20H10N2O4/c23-21(24)16-10-8-14-12-3-1-2-4-13(12)20-17(22(25)26)9-6-11-5-7-15(16)19(14)18(11)20/h1-10H
• InChIKey: JQYDZVJBMITZCN-UHFFFAOYSA-N

Properties

• Density: 1.557g/cm³ (Cal.)
• Boiling point: 597.099°C at 760 mmHg (Cal.)
• Flash point: 297.99°C (Cal.)