(1R,5S,6S)-8-Methyl-4-oxo-8-azabicyclo[3.2.1]oct-2-ene-6-carbonitrile
[CAS# 77603-73-7]

Identification

• Name: (1R,5S,6S)-8-Methyl-4-oxo-8-azabicyclo[3.2.1]oct-2-ene-6-carbonitrile
• Molecular Formula: C₉H₁₀N₂O
• Molecular Weight: 162.19
• CAS Registry Number: 77603-73-7
• SMILES: CN1[C@@H]2C[C@@H]([C@H]1C(=O)C=C2)C#N
• InChI: 1S/C9H10N2O/c1-11-7-2-3-8(12)9(11)6(4-7)5-10/h2-3,6-7,9H,4H2,1H3/t6-,7+,9+/m1/s1
• InChIKey: KBTKKJKGYHXAOU-FJXKBIBVSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 336.2±42.0°C at 760 mmHg (Cal.)
• Flash point: 157.1±27.9°C (Cal.)