2-{[3-(Hydroxymethyl)-1H-indol-1-yl]methyl}benzonitrile
[CAS# 676336-35-9]

Identification

• Name: 2-{[3-(Hydroxymethyl)-1H-indol-1-yl]methyl}benzonitrile
• Molecular Formula: C₁₇H₁₄N₂O
• Molecular Weight: 262.31
• CAS Registry Number: 676336-35-9
• SMILES: c1ccc(c(c1)Cn2cc(c3c2cccc3)CO)C#N
• InChI: 1S/C17H14N2O/c18-9-13-5-1-2-6-14(13)10-19-11-15(12-20)16-7-3-4-8-17(16)19/h1-8,11,20H,10,12H2
• InChIKey: XWUSMFAYJABAJM-UHFFFAOYSA-N

Properties

• Density: 1.163g/cm³ (Cal.)
• Boiling point: 512.476°C at 760 mmHg (Cal.)
• Flash point: 263.736°C (Cal.)
• Refractive index: 1.627 (Cal.)