8-Hydroxy-1,3,6-Pyrenetrisulfonic Acid
[CAS# 27928-00-3]

Identification

• Name: 8-Hydroxy-1,3,6-Pyrenetrisulfonic Acid
• Synonyms: 11389 Green; 1-hydroxypyrene-3,6,8-trisulfonic acid; 8-hydroxy-1,3,6-pyrene trisulfonic acid
• Molecular Formula: C₁₆H₁₀O₁₀S₃
• Molecular Weight: 458.44
• CAS Registry Number: 27928-00-3
• SMILES: C1=CC2=C3C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=C(C1=C43)O)S(=O)(=O)O
• InChI: 1S/C16H10O10S3/c17-11-5-12(27(18,19)20)8-3-4-10-14(29(24,25)26)6-13(28(21,22)23)9-2-1-7(11)15(8)16(9)10/h1-6,17H,(H,18,19,20)(H,21,22,23)(H,24,25,26)
• InChIKey: OBJOZRVSMLPASY-UHFFFAOYSA-N

Properties

• Density: 2.0±0.1g/cm³ (Cal.)
• Refractive index: 1.874 (Cal.)

References

• (1): Irene Izzo, Sabina Licen, Nakia Maulucci, Giuseppina Autore, Stefania Marzocco, Paolo Tecilla and Francesco De Riccardis. Cationic calix[4]arenes as anion-selective ionophores, Chem. Commun., 2008, 2986.