8-(2-Phenoxyethyloxy)-3-(1H-Tetrazol-5-Yl)Coumarin
[CAS# 80916-90-1]

Identification

• Name: 8-(2-Phenoxyethyloxy)-3-(1H-Tetrazol-5-Yl)Coumarin
• Synonyms: 8-[2-(Phenoxy)Ethoxy]-3-(2H-Tetrazol-5-Yl)-2-Chromenone; 8-[2-(Phenoxy)Ethoxy]-3-(2H-Tetrazol-5-Yl)Coumarin; 8-[2-(Phenoxy)Ethoxy]-3-(2H-1,2,3,4-Tetrazol-5-Yl)Chromen-2-One
• Molecular Formula: C₁₈H₁₄N₄O₄
• Molecular Weight: 350.33
• CAS Registry Number: 80916-90-1
• SMILES: C2=CC=C1C=C(C(OC1=C2OCCOC3=CC=CC=C3)=O)C4=N[NH]N=N4
• InChI: 1S/C18H14N4O4/c23-18-14(17-19-21-22-20-17)11-12-5-4-8-15(16(12)26-18)25-10-9-24-13-6-2-1-3-7-13/h1-8,11H,9-10H2,(H,19,20,21,22)
• InChIKey: LNRPOCCRGUTYRK-UHFFFAOYSA-N

Properties

• Density: 1.423g/cm³ (Cal.)
• Boiling point: 648.659°C at 760 mmHg (Cal.)
• Flash point: 346.097°C (Cal.)