4-[2-Oxo-3-(2H-Tetrazol-5-Yl)Chromen-6-Yl]Oxybutanoic Acid
[CAS# 103876-50-2]

Identification

• Name: 4-[2-Oxo-3-(2H-Tetrazol-5-Yl)Chromen-6-Yl]Oxybutanoic Acid
• Synonyms: 4-[[2-Oxo-3-(2H-Tetrazol-5-Yl)-6-Chromenyl]Oxy]Butanoic Acid; 4-[2-Keto-3-(2H-Tetrazol-5-Yl)Chromen-6-Yl]Oxybutyric Acid; 4-[2-Oxo-3-(2H-1,2,3,4-Tetrazol-5-Yl)Chromen-6-Yl]Oxybutanoic Acid
• Molecular Formula: C₁₄H₁₂N₄O₅
• Molecular Weight: 316.27
• CAS Registry Number: 103876-50-2
• SMILES: C1=C(OCCCC(O)=O)C=CC2=C1C=C(C(O2)=O)C3=N[NH]N=N3
• InChI: 1S/C14H12N4O5/c19-12(20)2-1-5-22-9-3-4-11-8(6-9)7-10(14(21)23-11)13-15-17-18-16-13/h3-4,6-7H,1-2,5H2,(H,19,20)(H,15,16,17,18)
• InChIKey: RGIJGAGHEILQIE-UHFFFAOYSA-N

Properties

• Density: 1.54g/cm³ (Cal.)
• Boiling point: 696.918°C at 760 mmHg (Cal.)
• Flash point: 375.283°C (Cal.)