2-Phenylisatogen
[CAS# 1969-74-0]

Identification

• Name: 2-Phenylisatogen
• Synonyms: 1-Oxido-2-Phenyl-Indol-1-Ium-3-One; 1-Oxido-2-Phenyl-3-Indol-1-Iumone; Nci60_008252
• Molecular Formula: C₁₄H₉NO₂
• Molecular Weight: 223.23
• CAS Registry Number: 1969-74-0
• SMILES: [O+]C1=C([N](C2=CC=CC=C12)[O-])C3=CC=CC=C3
• InChI: 1S/C14H9NO2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9H
• InChIKey: WXFLHMJSSLDOPA-UHFFFAOYSA-N

Properties

• Density: 1.319g/cm³ (Cal.)
• Melting point: 186°C (Expl.)
• Boiling point: 431.152°C at 760 mmHg (Cal.)
• Flash point: 219.589°C (Cal.)

References

• (1): Paola Astolfi, Lucedio Greci, Corrado Rizzoli, Paolo Sgarabotto and Giancarlo Marrosu. Radical intermediates in the peroxidation of indoles, J. Chem. Soc., Perkin Trans. 2, 2001, 0, 1634.