4-{[5-(Hydroxymethyl)-1H-Imidazol-1-Yl]Methyl}Benzonitrile
[CAS# 183500-36-9]

Identification

• Name: 4-{[5-(Hydroxymethyl)-1H-Imidazol-1-Yl]Methyl}Benzonitrile
• Synonyms: BENZONITRILE,4-[[5-(HYDROXYMETHYL)-1H-IMIDAZOL-1-YL]METHYL]-
• Molecular Formula: C₁₂H₁₁N₃O
• Molecular Weight: 213.24
• CAS Registry Number: 183500-36-9
• SMILES: C1=CC(=CC=C1CN2C=NC=C2CO)C#N
• InChI: 1S/C12H11N3O/c13-5-10-1-3-11(4-2-10)7-15-9-14-6-12(15)8-16/h1-4,6,9,16H,7-8H2
• InChIKey: ACFSBQWDVYWNRT-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 485.2±35.0°C at 760 mmHg (Cal.)
• Flash point: 247.2±25.9°C (Cal.)
• Refractive index: 1.619 (Cal.)