8-(3-Ethoxypropoxy)-3-(1H-Tetrazol-5-Yl)-2H-1-Benzopyran-2-One
[CAS# 80916-86-5]

Identification

• Name: 8-(3-Ethoxypropoxy)-3-(1H-Tetrazol-5-Yl)-2H-1-Benzopyran-2-One
• Synonyms: 8-(3-Ethoxypropoxy)-3-(2H-Tetrazol-5-Yl)-2-Chromenone; 8-(3-Ethoxypropoxy)-3-(2H-Tetrazol-5-Yl)Coumarin; 8-(3-Ethoxypropoxy)-3-(2H-1,2,3,4-Tetrazol-5-Yl)Chromen-2-One
• Molecular Formula: C₁₅H₁₆N₄O₄
• Molecular Weight: 316.32
• CAS Registry Number: 80916-86-5
• SMILES: C1=CC=C(OCCCOCC)C2=C1C=C(C(O2)=O)C3=N[NH]N=N3
• InChI: 1S/C15H16N4O4/c1-2-21-7-4-8-22-12-6-3-5-10-9-11(14-16-18-19-17-14)15(20)23-13(10)12/h3,5-6,9H,2,4,7-8H2,1H3,(H,16,17,18,19)
• InChIKey: PGCPUELHMDVHLL-UHFFFAOYSA-N

Properties

• Density: 1.354g/cm³ (Cal.)
• Boiling point: 571.652°C at 760 mmHg (Cal.)
• Flash point: 299.525°C (Cal.)