1-(4-Iodobenzyl)-1H-1,2,4-triazole
[CAS# 864068-93-9]

Identification

• Name: 1-(4-Iodobenzyl)-1H-1,2,4-triazole
• Synonyms: 1H-1,2,4-TRIAZOLE,1-[(4-IODOPHENYL)METHYL]-; MFCD08060477; ZINC05177717
• Molecular Formula: C₉H₈IN₃
• Molecular Weight: 285.08
• CAS Registry Number: 864068-93-9
• SMILES: Ic1ccc(cc1)Cn2ncnc2
• InChI: 1S/C9H8IN3/c10-9-3-1-8(2-4-9)5-13-7-11-6-12-13/h1-4,6-7H,5H2
• InChIKey: HCPXRFMOQIIBRI-UHFFFAOYSA-N

Properties

• Density: 1.802g/cm³ (Cal.)
• Boiling point: 380.014°C at 760 mmHg (Cal.)
• Flash point: 183.626°C (Cal.)
• Refractive index: 1.707 (Cal.)

Safety Data

• Safety Description: IRRITANT