2-(2-chloroacetyl)cyclopentene-1-carbonitrile
[CAS# 98545-90-5]

Identification

• Name: 2-(2-chloroacetyl)cyclopentene-1-carbonitrile
• Synonyms: 2-(2-chloroacetyl)cyclopent-1-enecarbonitrile; 2-(2-chloroacetyl)cyclopentene-1-carbonitrile
• Molecular Formula: C₈H₈ClNO
• Molecular Weight: 169.61
• CAS Registry Number: 98545-90-5
• SMILES: C1CC(=C(C1)C(=O)CCl)C#N
• InChI: 1S/C8H8ClNO/c9-4-8(11)7-3-1-2-6(7)5-10/h1-4H2
• InChIKey: BTHHNZRYJHJFFE-UHFFFAOYSA-N

Properties

• Density: 1.23g/cm³ (Cal.)
• Boiling point: 287.516°C at 760 mmHg (Cal.)
• Flash point: 127.685°C (Cal.)

References

• (1): Trave R, Merlini L, Garanti L. Ricerche sulla sintesi del nor-nepetalattone, Chimica e Industria (Milan), 1958, 40, 887-898