(3E)-4-(1H-Benzimidazol-1-yl)-3-penten-2-one
[CAS# 91164-78-2]

Identification

• Name: (3E)-4-(1H-Benzimidazol-1-yl)-3-penten-2-one
• Synonyms: (E)-4-(1H-benzo[d]imidazol-1-yl)pent-3-en-2-one
• Molecular Formula: C₁₂H₁₂N₂O
• Molecular Weight: 200.24
• CAS Registry Number: 91164-78-2
• SMILES: C/C(=C\C(=O)C)/n1cnc2c1cccc2
• InChI: 1S/C12H12N2O/c1-9(7-10(2)15)14-8-13-11-5-3-4-6-12(11)14/h3-8H,1-2H3/b9-7+
• InChIKey: JLHTZSPONYGXBM-VQHVLOKHSA-N

Properties

• Density: 1.114g/cm³ (Cal.)
• Boiling point: 367.526°C at 760 mmHg (Cal.)
• Flash point: 176.074°C (Cal.)