Benzo[a]Pyren-7-Ol
[CAS# 37994-82-4]

Identification

• Name: Benzo[a]Pyren-7-Ol
• Synonyms: 7-Benzo[A]Pyrenol; 3-06-00-03811 (Beilstein Handbook Reference); 7-Hydroxybenzo(A)Pyrene
• Molecular Formula: C₂₀H₁₂O
• Molecular Weight: 268.31
• CAS Registry Number: 37994-82-4
• SMILES: C1=CC=C2C(=C1O)C=C3C=CC4=CC=CC5=CC=C2C3=C45
• InChI: 1S/C20H12O/c21-18-6-2-5-15-16-10-9-13-4-1-3-12-7-8-14(11-17(15)18)20(16)19(12)13/h1-11,21H
• InChIKey: CNQAYISXCZTDQX-UHFFFAOYSA-N

Properties

• Density: 1.379g/cm³ (Cal.)
• Boiling point: 527.227°C at 760 mmHg (Cal.)
• Flash point: 252.929°C (Cal.)