1-Bromo-4-[(1E)-2-Nitro-1-Propen-1-Yl]Benzene
[CAS# 21892-60-4]

Identification

• Name: 1-Bromo-4-[(1E)-2-Nitro-1-Propen-1-Yl]Benzene
• Synonyms: 1-bromo-4-(2-nitroprop-1-enyl)benzene; TL80073636
• Molecular Formula: C₉H₈BrNO₂
• Molecular Weight: 242.07
• CAS Registry Number: 21892-60-4
• SMILES: C/C(=C\C1=CC=C(C=C1)Br)/[N+](=O)[O-]
• InChI: 1S/C9H8BrNO2/c1-7(11(12)13)6-8-2-4-9(10)5-3-8/h2-6H,1H3/b7-6+
• InChIKey: YHCYQNXJXRRFFM-VOTSOKGWSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 322.9±17.0°C at 760 mmHg (Cal.)
• Flash point: 149.1±20.9°C (Cal.)
• Refractive index: 1.617 (Cal.)

References

• (1): Bailin Li . (E)-1-Bromo-4-(2-nitroprop-1-enyl)benzene , Acta Cryst (2009). E65, o3174Â Â