6-Oxiranylbenzo[a]Pyrene
[CAS# 61695-69-0]

Identification

• Name: 6-Oxiranylbenzo[a]Pyrene
• Synonyms: 2-(6-Benzo[B]Pyrenyl)Oxirane; 6-Oxiranylbenzo(A)Pyrene; Benzo(A)Pyrene, 6-Oxiranyl-
• Molecular Formula: C₂₂H₁₄O
• Molecular Weight: 294.35
• CAS Registry Number: 61695-69-0
• SMILES: C2=CC1=CC=CC6=C1C3=C(C5=C(C(=C23)C4CO4)C=CC=C5)C=C6
• InChI: 1S/C22H14O/c1-2-7-16-15(6-1)17-10-8-13-4-3-5-14-9-11-18(22(17)20(13)14)21(16)19-12-23-19/h1-11,19H,12H2
• InChIKey: SZOGYVPLFPZVIH-UHFFFAOYSA-N

Properties

• Density: 1.368g/cm³ (Cal.)
• Boiling point: 539.481°C at 760 mmHg (Cal.)
• Flash point: 259.245°C (Cal.)