1,6-Dinitro-9,10,11,12-Tetrahydrobenzo(E)Pyrene
[CAS# 120812-51-3]

Identification

• Name: 1,6-Dinitro-9,10,11,12-Tetrahydrobenzo(E)Pyrene
• Synonyms: 1,6-Dinitro-9,10,11,12-Tetrahydrobenzo(E)Pyrene; 1,6-Dinitro-H4-Benzo(E)Pyrene; 9,10,11,12-Tetrahydro-1,6-Dinitrobenzo(E)Pyrene
• Molecular Formula: C₂₀H₁₄N₂O₄
• Molecular Weight: 346.34
• CAS Registry Number: 120812-51-3
• SMILES: C2=CC3=C1CCCCC1=C4C(=CC=C5C=CC(=C2[N+]([O-])=O)C3=C45)[N+]([O-])=O
• InChI: 1S/C20H14N2O4/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/h5-10H,1-4H2
• InChIKey: QRIUZXYUEZGXBP-UHFFFAOYSA-N

Properties

• Density: 1.49g/cm³ (Cal.)
• Boiling point: 579.303°C at 760 mmHg (Cal.)
• Flash point: 284.001°C (Cal.)