5-Amino-2-Phenyl-2H-1,2,3-Triazole-4-Carboxylic Acid
[CAS# 400073-84-9]

Identification

• Name: 5-Amino-2-Phenyl-2H-1,2,3-Triazole-4-Carboxylic Acid
• Synonyms: 5-amino-2-phenyl-1,2,3-triazole-4-carboxylic acid; 5-Amino-2-phenyl-2H-[1,2,3]triazole-4-carboxylic acid; 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylic acid
• Molecular Formula: C₉H₈N₄O₂
• Molecular Weight: 204.19
• CAS Registry Number: 400073-84-9
• SMILES: O=C(O)c1nn(nc1N)c2ccccc2
• InChI: 1S/C9H8N4O2/c10-8-7(9(14)15)11-13(12-8)6-4-2-1-3-5-6/h1-5H,(H2,10,12)(H,14,15)
• InChIKey: JBZRUGXIAJOSDU-UHFFFAOYSA-N

Properties

• Density: 1.546g/cm³ (Cal.)
• Melting point: 239°C (Expl.)
• Boiling point: 486.025°C at 760 mmHg (Cal.)
• Flash point: 247.739°C (Cal.)
• Refractive index: 1.728 (Cal.)

Safety Data

• Safety Description: Irritant