2-Allyl-5-hydroxy-1-methyl-3-oxocyclopentanecarbonitrile
[CAS# 69745-72-8]

Identification

• Name: 2-Allyl-5-hydroxy-1-methyl-3-oxocyclopentanecarbonitrile
• Synonyms: 2-Allyl-5-hydroxy-1-methyl-3-oxocyclopentanecarbonitrile #
• Molecular Formula: C₁₀H₁₃NO₂
• Molecular Weight: 179.22
• CAS Registry Number: 69745-72-8
• SMILES: N#CC1(C)C(C(=O)CC1O)C\C=C
• InChI: 1S/C10H13NO2/c1-3-4-7-8(12)5-9(13)10(7,2)6-11/h3,7,9,13H,1,4-5H2,2H3
• InChIKey: DVPCNKHYBWOEDZ-UHFFFAOYSA-N

Properties

• Density: 1.115g/cm³ (Cal.)
• Boiling point: 331.721°C at 760 mmHg (Cal.)
• Flash point: 154.42°C (Cal.)