2-(2H-Tetrazol-5-Yl)Benzoic Acid
[CAS# 13947-58-5]

Identification

• Name: 2-(2H-Tetrazol-5-Yl)Benzoic Acid
• Synonyms: 2-(1H-1,2,3,4-tetraazol-5-yl)benzoic acid; 2-(1H-tetraazol-5-yl)benzoic acid; 2-(1H-Tetraazol-5-yl)benzoic acid #
• Molecular Formula: C₈H₆N₄O₂
• Molecular Weight: 190.16
• CAS Registry Number: 13947-58-5
• SMILES: O=C(O)c1ccccc1c2nnnn2
• InChI: 1S/C8H6N4O2/c13-8(14)6-4-2-1-3-5(6)7-9-11-12-10-7/h1-4H,(H,13,14)(H,9,10,11,12)
• InChIKey: QRKJBXMXOAQYEC-UHFFFAOYSA-N

Properties

• Density: 1.518g/cm³ (Cal.)
• Boiling point: 473.638°C at 760 mmHg (Cal.)
• Flash point: 240.248°C (Cal.)
• Refractive index: 1.664 (Cal.)

Safety Data

• Safety Description: IRRITANT