6-Heptynenitrile
[CAS 15295-69-9]

Identification

• Name: 6-Heptynenitrile
• Synonyms: InChI=1/C7H9N/c1-2-3-4-5-6-7-8/h1H,3-6H2
• Molecular Formula: C₇H₉N
• Molecular Weight: 107.15
• CAS Registry Number: 15295-69-9
• SMILES: C#CCCCCC#N
• InChI: 1S/C7H9N/c1-2-3-4-5-6-7-8/h1H,3-6H2
• InChIKey: BIGRRVLEKCQFHS-UHFFFAOYSA-N

Properties

• Density: 0.9±0.1g/cm³ (Cal.)
• Boiling point: 206.3±23.0°C at 760 mmHg (Cal.)
• Flash point: 78.2±15.1°C (Cal.)
• Refractive index: 1.444 (Cal.)

References

• (1): Edwin C. Davison, Martin E. Fox, Andrew B. Holmes, Stephen D. Roughley, Catherine J. Smith, Geoffrey M. Williams, John E. Davies, Paul R. Raithby, Joseph P. Adams, Ian T. Forbes, Neil J. Press and Mer vyn J. Thompson. Nitrone dipolar cycloaddition routes to piperidines and indolizidines. Part 9. Formal synthesis of (-)-pinidine and total synthesis of (-)-histrionicotoxin, (+)-histrionicotoxin and (-)-histrion icotoxin 235A, J. Chem. Soc., Perkin Trans. 1, 2002, 0, 1494.