2-(3-Buten-1-yl)-6-oxo-1-cyclohexene-1-carbonitrile
[CAS# 634929-03-6]

Identification

• Name: 2-(3-Buten-1-yl)-6-oxo-1-cyclohexene-1-carbonitrile
• Synonyms: 2-(but-3-en-1-yl)-6-oxocyclohex-1-enecarbonitrile
• Molecular Formula: C₁₁H₁₃NO
• Molecular Weight: 175.23
• CAS Registry Number: 634929-03-6
• SMILES: C=CCCC1=C(C(=O)CCC1)C#N
• InChI: 1S/C11H13NO/c1-2-3-5-9-6-4-7-11(13)10(9)8-12/h2H,1,3-7H2
• InChIKey: DCOPRDVPZMHEPE-UHFFFAOYSA-N

Properties

• Density: 1.025g/cm³ (Cal.)
• Boiling point: 301.632°C at 760 mmHg (Cal.)
• Flash point: 136.222°C (Cal.)
• Refractive index: 1.499 (Cal.)