4-Methoxybenzo(a)Pyrene
[CAS# 56182-99-1]

Identification

• Name: 4-Methoxybenzo(a)Pyrene
• Synonyms: Benzo(A)Pyrene, 4-Methoxy-; 4-Methoxybenzo(A)Pyrene
• Molecular Formula: C₂₁H₁₄O
• Molecular Weight: 282.34
• CAS Registry Number: 56182-99-1
• SMILES: C1=C4C3=C2C(=C1OC)C=CC=C2C=CC3=C5C(=C4)C=CC=C5
• InChI: 1S/C21H14O/c1-22-19-12-15-11-14-5-2-3-7-16(14)17-10-9-13-6-4-8-18(19)20(13)21(15)17/h2-12H,1H3
• InChIKey: CNVYLULNAHQNNC-UHFFFAOYSA-N

Properties

• Density: 1.283g/cm³ (Cal.)
• Boiling point: 498.57°C at 760 mmHg (Cal.)
• Flash point: 206.394°C (Cal.)