(4-Amino-5-cyano-1H-imidazol-1-yl)acetic acid
[CAS# 87460-74-0]

Identification

• Name: (4-Amino-5-cyano-1H-imidazol-1-yl)acetic acid
• Synonyms: 2-(4-amino-5-cyano-1H-imidazol-1-yl)acetic acid
• Molecular Formula: C₆H₆N₄O₂
• Molecular Weight: 166.14
• CAS Registry Number: 87460-74-0
• SMILES: c1nc(c(n1CC(=O)O)C#N)N
• InChI: 1S/C6H6N4O2/c7-1-4-6(8)9-3-10(4)2-5(11)12/h3H,2,8H2,(H,11,12)
• InChIKey: XSDXJPXUWBMZCY-UHFFFAOYSA-N

Properties

• Density: 1.594g/cm³ (Cal.)
• Boiling point: 600.136°C at 760 mmHg (Cal.)
• Flash point: 316.751°C (Cal.)