(6-Nitro-2-Oxo-1,3-Benzoxazol-3(2H)-Yl)Acetic Acid
[CAS# 19739-41-4]

Identification

• Name: (6-Nitro-2-Oxo-1,3-Benzoxazol-3(2H)-Yl)Acetic Acid
• Synonyms: 2-(2-Keto-6-Nitro-1,3-Benzoxazol-3-Yl)Acetate; 2-(6-Nitro-2-Oxo-1,3-Benzoxazol-3-Yl)Ethanoate; Zinc03399129
• Molecular Formula: C₉H₅N₂O₆
• Molecular Weight: 237.15
• CAS Registry Number: 19739-41-4
• SMILES: C2=C1OC(=O)N(C1=CC=C2[N+]([O-])=O)CC([O-])=O
• InChI: 1S/C9H6N2O6/c12-8(13)4-10-6-2-1-5(11(15)16)3-7(6)17-9(10)14/h1-3H,4H2,(H,12,13)/p-1
• InChIKey: IAYXNJKBPWCTMZ-UHFFFAOYSA-M

Properties

• Boiling point: 474.007°C at 760 mmHg (Cal.)
• Flash point: 240.471°C (Cal.)