11-Methylbenzo[a]Pyrene
[CAS# 16757-80-5]

Identification

• Name: 11-Methylbenzo[a]Pyrene
• Synonyms: Brn 2109259; Ccris 2444; 11-Methylbenzo(A)Pyrene
• Molecular Formula: C₂₁H₁₄
• Molecular Weight: 266.34
• CAS Registry Number: 16757-80-5
• SMILES: C1=C5C3=C(C2=C1C=CC=C2)C(=CC4=C3C(=CC=C4)C=C5)C
• InChI: 1S/C21H14/c1-13-11-16-7-4-6-14-9-10-17-12-15-5-2-3-8-18(15)19(13)21(17)20(14)16/h2-12H,1H3
• InChIKey: ZWJRHJOLMBZEMI-UHFFFAOYSA-N

Properties

• Density: 1.254g/cm³ (Cal.)
• Boiling point: 479.361°C at 760 mmHg (Cal.)
• Flash point: 236.729°C (Cal.)