(E)-6-Oxohept-4-Enenitrile
[CAS# 120113-87-3]

Identification

• Name: (E)-6-Oxohept-4-Enenitrile
• Synonyms: 4-Heptenenitrile, 6-oxo-, (4E)-
• Molecular Formula: C₇H₉NO
• Molecular Weight: 123.15
• CAS Registry Number: 120113-87-3
• SMILES: N#CCC/C=C/C(=O)C
• InChI: 1S/C7H9NO/c1-7(9)5-3-2-4-6-8/h3,5H,2,4H2,1H3/b5-3+
• InChIKey: JZTIIUUKUQQVNE-HWKANZROSA-N

Properties

• Density: 0.961g/cm³ (Cal.)
• Boiling point: 271.615°C at 760 mmHg (Cal.)
• Flash point: 118.069°C (Cal.)
• Refractive index: 1.45 (Cal.)