2-(1,2,4-Benzotriazin-3-Yl)Acetic Acid
[CAS# 77475-33-3]

Identification

• Name: 2-(1,2,4-Benzotriazin-3-Yl)Acetic Acid
• Synonyms: 2-(1,2,4-Benzotriazin-3-Yl)Ethanoic Acid; 1,2,4-Benzotriazine-3-Acetic Acid
• Molecular Formula: C₉H₇N₃O₂
• Molecular Weight: 189.17
• CAS Registry Number: 77475-33-3
• SMILES: C1=CC=CC2=NN=C(N=C12)CC(O)=O
• InChI: 1S/C9H7N3O2/c13-9(14)5-8-10-6-3-1-2-4-7(6)11-12-8/h1-4H,5H2,(H,13,14)
• InChIKey: BFLNXWWHKYAJCP-UHFFFAOYSA-N

Properties

• Density: 1.448g/cm³ (Cal.)
• Boiling point: 453.6°C at 760 mmHg (Cal.)
• Flash point: 228.129°C (Cal.)