3-Aminobenzo[a]Pyrene
[CAS# 98151-92-9]

Identification

• Name: 3-Aminobenzo[a]Pyrene
• Synonyms: 3-Benzo[H]Pyrenamine; Benzo[H]Pyren-3-Ylamine; 3-Aminobenzo(A)Pyrene
• Molecular Formula: C₂₀H₁₃N
• Molecular Weight: 267.33
• CAS Registry Number: 98151-92-9
• SMILES: C1=CC=CC2=C1C=C5C3=C4C(=CC=C23)C=CC(=C4C=C5)N
• InChI: 1S/C20H13N/c21-18-10-7-12-5-8-16-15-4-2-1-3-13(15)11-14-6-9-17(18)19(12)20(14)16/h1-11H,21H2
• InChIKey: QBWLAIGPKULPQC-UHFFFAOYSA-N

Properties

• Density: 1.348g/cm³ (Cal.)
• Boiling point: 529.994°C at 760 mmHg (Cal.)
• Flash point: 306.047°C (Cal.)