2-Phenyl-2H-Tetrazole-5-Carboxylic Acid
[CAS# 54798-92-4]

Identification

• Name: 2-Phenyl-2H-Tetrazole-5-Carboxylic Acid
• Synonyms: 2-Phenyl-1,2,3,4-Tetrazole-5-Carboxylic Acid; 2H-Tetrazole-5-Carboxylic Acid, 2-Phenyl-; 2-Phenyltetrazole-5-Carboxylic Acid
• Molecular Formula: C₈H₆N₄O₂
• Molecular Weight: 190.16
• CAS Registry Number: 54798-92-4
• SMILES: C2=C([N]1N=C(C(O)=O)N=N1)C=CC=C2
• InChI: 1S/C8H6N4O2/c13-8(14)7-9-11-12(10-7)6-4-2-1-3-5-6/h1-5H,(H,13,14)
• InChIKey: YFIIOEOZTVRRDK-UHFFFAOYSA-N

Properties

• Density: 1.536g/cm³ (Cal.)
• Boiling point: 438.699°C at 760 mmHg (Cal.)
• Flash point: 219.117°C (Cal.)