3-[(5-Ethyl-1H-pyrrol-2-yl)carbonyl]benzonitrile
[CAS# 728010-37-5]

Identification

• Name: 3-[(5-Ethyl-1H-pyrrol-2-yl)carbonyl]benzonitrile
• Synonyms: 3-(5-ethyl-1H-pyrrole-2-carbonyl)benzonitrile
• Molecular Formula: C₁₄H₁₂N₂O
• Molecular Weight: 224.26
• CAS Registry Number: 728010-37-5
• SMILES: CCc1ccc([nH]1)C(=O)c2cccc(c2)C#N
• InChI: 1S/C14H12N2O/c1-2-12-6-7-13(16-12)14(17)11-5-3-4-10(8-11)9-15/h3-8,16H,2H2,1H3
• InChIKey: YBULOWKWFXUBNI-UHFFFAOYSA-N

Properties

• Density: 1.208g/cm³ (Cal.)
• Boiling point: 405.236°C at 760 mmHg (Cal.)
• Flash point: 198.88°C (Cal.)
• Refractive index: 1.605 (Cal.)