2-Benzyl-1H-Indole-5-Carbonitrile
[CAS# 179748-04-0]

Identification

• Name: 2-Benzyl-1H-Indole-5-Carbonitrile
• Synonyms: 1H-Indole-5-carbonitrile,2-(phenylmethyl)-; 2-benzyl-1H-indole-5-carbonitrile; 2-Benzyl-5-cyanoindole
• Molecular Formula: C₁₆H₁₂N₂
• Molecular Weight: 232.28
• CAS Registry Number: 179748-04-0
• SMILES: c1ccc(cc1)Cc2cc3cc(ccc3[nH]2)C#N
• InChI: 1S/C16H12N2/c17-11-13-6-7-16-14(8-13)10-15(18-16)9-12-4-2-1-3-5-12/h1-8,10,18H,9H2
• InChIKey: VKYBDBGOLWABIR-UHFFFAOYSA-N

Properties

• Density: 1.223g/cm³ (Cal.)
• Boiling point: 452.938°C at 760 mmHg (Cal.)
• Flash point: 145.448°C (Cal.)
• Refractive index: 1.684 (Cal.)