4-Nitro-9,10,11,12-Tetrahydrobenzo(E)Pyrene
[CAS# 134998-79-1]

Identification

• Name: 4-Nitro-9,10,11,12-Tetrahydrobenzo(E)Pyrene
• Synonyms: Benzo(E)Pyrene, 9,10,11,12-Tetrahydro-4-Nitro-; Ccris 8057
• Molecular Formula: C₂₀H₁₅NO₂
• Molecular Weight: 301.34
• CAS Registry Number: 134998-79-1
• SMILES: C2=C([N+]([O-])=O)C1=CC=CC4=C1C3=C2C=CC=C3C5=C4CCCC5
• InChI: 1S/C20H15NO2/c22-21(23)18-11-12-5-3-8-15-13-6-1-2-7-14(13)16-9-4-10-17(18)20(16)19(12)15/h3-5,8-11H,1-2,6-7H2
• InChIKey: IPLPTZVDWUUJQN-UHFFFAOYSA-N

Properties

• Density: 1.366g/cm³ (Cal.)
• Boiling point: 517.258°C at 760 mmHg (Cal.)
• Flash point: 251.869°C (Cal.)