5-Amino-1-phenyl-1H-1,2,4-triazole-3-carboxylic acid
[CAS# 68207-58-9]

Identification

• Name: 5-Amino-1-phenyl-1H-1,2,4-triazole-3-carboxylic acid
• Synonyms: 5-amino-1-phenyl-1H-1,2,4-triazole-3-carboxylic acid
• Molecular Formula: C₉H₈N₄O₂
• Molecular Weight: 204.19
• CAS Registry Number: 68207-58-9
• SMILES: c1ccc(cc1)n2c(nc(n2)C(=O)O)N
• InChI: 1S/C9H8N4O2/c10-9-11-7(8(14)15)12-13(9)6-4-2-1-3-5-6/h1-5H,(H,14,15)(H2,10,11,12)
• InChIKey: LHMOTEDBIDZIKF-UHFFFAOYSA-N

Properties

• Density: 1.546g/cm³ (Cal.)
• Boiling point: 516.026°C at 760 mmHg (Cal.)
• Flash point: 265.883°C (Cal.)