(5-p-Tolyl-Tetrazol-2-Yl)-Acetic Acid
[CAS# 81595-00-8]

Identification

• Name: (5-p-Tolyl-Tetrazol-2-Yl)-Acetic Acid
• Synonyms: 2-[5-(4-Methylphenyl)-2-Tetrazolyl]Acetate; 2-[5-(4-Methylphenyl)-1,2,3,4-Tetrazol-2-Yl]Ethanoate; Zinc00083236
• Molecular Formula: C₁₀H₉N₄O₂
• Molecular Weight: 217.21
• CAS Registry Number: 81595-00-8
• SMILES: C2=C(C1=N[N](N=N1)CC([O-])=O)C=CC(=C2)C
• InChI: 1S/C10H10N4O2/c1-7-2-4-8(5-3-7)10-11-13-14(12-10)6-9(15)16/h2-5H,6H2,1H3,(H,15,16)/p-1
• InChIKey: QBJSWVLDHWIJDK-UHFFFAOYSA-M

Properties

• Boiling point: 457.493°C at 760 mmHg (Cal.)
• Flash point: 230.484°C (Cal.)