(1S,4R)-2-(2-Propyn-1-yl)-2-azabicyclo[2.2.1]hept-5-en-3-one
[CAS# 666256-76-4]

Identification

• Name: (1S,4R)-2-(2-Propyn-1-yl)-2-azabicyclo[2.2.1]hept-5-en-3-one
• Synonyms: (1S,4R)-2-(prop-2-yn-1-yl)-2-azabicyclo[2.2.1]hept-5-en-3-one
• Molecular Formula: C₉H₉NO
• Molecular Weight: 147.17
• CAS Registry Number: 666256-76-4
• SMILES: C#CCN1[C@H]2C[C@@H](C1=O)C=C2
• InChI: 1S/C9H9NO/c1-2-5-10-8-4-3-7(6-8)9(10)11/h1,3-4,7-8H,5-6H2/t7-,8+/m0/s1
• InChIKey: GLLMXHHDLSINQW-JGVFFNPUSA-N

Properties

• Density: 1.188g/cm³ (Cal.)
• Boiling point: 287.245°C at 760 mmHg (Cal.)
• Flash point: 134.709°C (Cal.)
• Refractive index: 1.573 (Cal.)