1-Methylbenzo[Pqr]Tetraphene
[CAS# 25167-89-9]

Identification

• Name: 1-Methylbenzo[Pqr]Tetraphene
• Synonyms: 1-Methylbenzo(a)pyrene; 1-METHYLBENZO[A]PYRENE; 1-Methylbenzopyrene
• Molecular Formula: C₂₁H₁₄
• Molecular Weight: 266.34
• CAS Registry Number: 25167-89-9
• SMILES: c45cc2ccc1ccc(c3c1c2c(cc3)c4cccc5)C
• InChI: 1S/C21H14/c1-13-6-7-14-8-9-16-12-15-4-2-3-5-18(15)19-11-10-17(13)20(14)21(16)19/h2-12H,1H3
• InChIKey: WMAYPBMLSQKCHA-UHFFFAOYSA-N

Properties

• Density: 1.254g/cm³ (Cal.)
• Boiling point: 479.361°C at 760 mmHg (Cal.)
• Flash point: 236.729°C (Cal.)
• Refractive index: 1.853 (Cal.)