6-[2-Oxo-3-(2H-Tetrazol-5-Yl)Chromen-5-Yl]Oxyhexanoic Acid
[CAS# 103876-54-6]

Identification

• Name: 6-[2-Oxo-3-(2H-Tetrazol-5-Yl)Chromen-5-Yl]Oxyhexanoic Acid
• Synonyms: 6-[[2-Oxo-3-(2H-Tetrazol-5-Yl)-5-Chromenyl]Oxy]Hexanoic Acid; 6-[2-Keto-3-(2H-Tetrazol-5-Yl)Chromen-5-Yl]Oxyhexanoic Acid; 6-[2-Oxo-3-(2H-1,2,3,4-Tetrazol-5-Yl)Chromen-5-Yl]Oxyhexanoic Acid
• Molecular Formula: C₁₆H₁₆N₄O₅
• Molecular Weight: 344.33
• CAS Registry Number: 103876-54-6
• SMILES: C1=C2C(=C(OCCCCCC(=O)O)C=C1)C=C(C(O2)=O)C3=N[NH]N=N3
• InChI: 1S/C16H16N4O5/c21-14(22)7-2-1-3-8-24-12-5-4-6-13-10(12)9-11(16(23)25-13)15-17-19-20-18-15/h4-6,9H,1-3,7-8H2,(H,21,22)(H,17,18,19,20)
• InChIKey: BBVFZIRSDSZYND-UHFFFAOYSA-N

Properties

• Density: 1.444g/cm³ (Cal.)
• Boiling point: 684.993°C at 760 mmHg (Cal.)
• Flash point: 368.071°C (Cal.)