Benzo(a)Pyrenyl-7-Sulphate
[CAS# 63785-42-2]

Identification

• Name: Benzo(a)Pyrenyl-7-Sulphate
• Synonyms: 7-Benzo[A]Pyrenyl Hydrogen Sulfate; Benzo(A)Pyrene-7-Sulfate; Benzo(A)Pyrenyl-7-Sulfate
• Molecular Formula: C₂₀H₁₂O₄S
• Molecular Weight: 348.37
• CAS Registry Number: 63785-42-2
• SMILES: C1=C3C=CC4=CC=CC5=CC=C(C2=CC=CC(=C12)O[S](=O)(=O)O)C3=C45
• InChI: 1S/C20H12O4S/c21-25(22,23)24-18-6-2-5-15-16-10-9-13-4-1-3-12-7-8-14(11-17(15)18)20(16)19(12)13/h1-11H,(H,21,22,23)
• InChIKey: MOHHQIRDSANJJN-UHFFFAOYSA-N

Properties

• Density: 1.568g/cm³ (Cal.)