2-Imino-5-oxo-1,4-cyclohexanedicarbonitrile
[CAS# 90004-02-7]

Identification

• Name: 2-Imino-5-oxo-1,4-cyclohexanedicarbonitrile
• Synonyms: 2-imino-5-oxocyclohexane-1,4-dicarbonitrile
• Molecular Formula: C₈H₇N₃O
• Molecular Weight: 161.16
• CAS Registry Number: 90004-02-7
• SMILES: C1C(C(=O)CC(C1=N)C#N)C#N
• InChI: 1S/C8H7N3O/c9-3-5-2-8(12)6(4-10)1-7(5)11/h5-6,11H,1-2H2
• InChIKey: RUCXTBHZOLVURV-UHFFFAOYSA-N

Properties

• Density: 1.339g/cm³ (Cal.)
• Boiling point: 536.462°C at 760 mmHg (Cal.)
• Flash point: 278.242°C (Cal.)