2-(2-(5-Carboxy)Oxazole)-5-Hydroxy-6-Aminobenzofuran-N,N,O-Triacetic Acid
[CAS# 120551-15-7]

Identification

• Name: 2-(2-(5-Carboxy)Oxazole)-5-Hydroxy-6-Aminobenzofuran-N,N,O-Triacetic Acid
• Synonyms: 2-[6-(Bis(Carboxymethyl)Amino)-5-(Carboxymethyloxy)Benzofuran-2-Yl]Oxazole-5-Carboxylic Acid; 2-[6-(Bis(Carboxymethyl)Amino)-5-(Carboxymethyloxy)-2-Benzofuranyl]-5-Oxazolecarboxylic Acid; 2-(2-(5-Carboxy)Oxazole)-5-Hydroxy-6-Aminobenzofuran-N,N,O-Triacetic Acid
• Molecular Formula: C₁₈H₁₄N₂O₁₁
• Molecular Weight: 434.32
• CAS Registry Number: 120551-15-7
• SMILES: C1=C(C(=CC2=C1OC(=C2)C3=NC=C(O3)C(=O)O)OCC(=O)O)N(CC(=O)O)CC(=O)O
• InChI: 1S/C18H14N2O11/c21-14(22)5-20(6-15(23)24)9-3-10-8(1-11(9)29-7-16(25)26)2-12(30-10)17-19-4-13(31-17)18(27)28/h1-4H,5-7H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28)
• InChIKey: PDURUKZNVHEHGO-UHFFFAOYSA-N

Properties

• Density: 1.699g/cm³ (Cal.)
• Boiling point: 803.267°C at 760 mmHg (Cal.)
• Flash point: 439.6°C (Cal.)