4-Nitro-1-Azatetracyclo[2.2.0.0^2,6.0^3,5]Hexane
[CAS# 151141-40-1]

Identification

• Name: 4-Nitro-1-Azatetracyclo[2.2.0.0^2,6.0^3,5]Hexane
• Synonyms: (2S,3R,4S)-4-nitro-1-azaprismane
• Molecular Formula: C₅H₄N₂O₂
• Molecular Weight: 124.10
• CAS Registry Number: 151141-40-1
• SMILES: C12C3C1(N4C2C34)[N+](=O)[O-]
• InChI: 1S/C5H4N2O2/c8-7(9)5-1-2(5)4-3(1)6(4)5/h1-4H
• InChIKey: MIHWATXFAPWGNN-UHFFFAOYSA-N

Properties

• Density: 2.131g/cm³ (Cal.)
• Boiling point: 238.285°C at 760 mmHg (Cal.)
• Flash point: 97.912°C (Cal.)
• Refractive index: 1.889 (Cal.)