Benzo(a)Pyrene 7,8-Dihydrodiol
[CAS# 13345-25-0]

Identification

• Name: Benzo(a)Pyrene 7,8-Dihydrodiol
• Synonyms: Cis-7,8-Dihydrobenzo[A]Pyrendiol; Benzo[A]Pyrene-7,8-Dihydrodiol; Benzo[A]Pyrene-7,8-Diol
• Molecular Formula: C₂₀H₁₄O₂
• Molecular Weight: 286.33
• CAS Registry Number: 13345-25-0
• SMILES: C1=C5C(=C4C2=C1C=CC3=C2C(=CC=C3)C=C4)C=CC(O)C5O
• InChI: 1S/C20H14O2/c21-17-9-8-14-15-7-6-12-3-1-2-11-4-5-13(19(15)18(11)12)10-16(14)20(17)22/h1-10,17,20-22H
• InChIKey: YDXRLMMGARHIIC-UHFFFAOYSA-N

Properties

• Density: 1.46g/cm³ (Cal.)
• Boiling point: 553.277°C at 760 mmHg (Cal.)
• Flash point: 268.564°C (Cal.)