4-Iminocyclohexa-2,5-Dien-1-One
[CAS# 3009-34-5]

Identification

• Name: 4-Iminocyclohexa-2,5-Dien-1-One
• Synonyms: 4-Imino-1-Cyclohexa-2,5-Dienone; 1,4-Benzoquinoneimine; 2,5-Cyclohexadien-1-One, 4-Imino-
• Molecular Formula: C₆H₅NO
• Molecular Weight: 107.11
• CAS Registry Number: 3009-34-5
• SMILES: O=C1C=CC(=N)C=C1
• InChI: 1S/C6H5NO/c7-5-1-3-6(8)4-2-5/h1-4,7H
• InChIKey: WELKBINNNXKQQS-UHFFFAOYSA-N

Properties

• Density: 1.136g/cm³ (Cal.)
• Boiling point: 224.961°C at 760 mmHg (Cal.)
• Flash point: 89.854°C (Cal.)

References

• (1): Faiella et al.. An artificial di-iron oxo-protein with phenol oxidase activity, Nature Chemical Biology, 2009