2-[(4-Nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid
[CAS# 64917-85-7]

Identification

• Name: 2-[(4-Nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid
• Synonyms: 2-[(7-Nitrobenzofurazan-4-Yl)Amino]Propionic Acid; Nsc328385
• Molecular Formula: C₉H₈N₄O₅
• Molecular Weight: 252.19
• CAS Registry Number: 64917-85-7
• SMILES: C2=C([N+]([O-])=O)C1=NON=C1C(=C2)NC(C(=O)O)C
• InChI: 1S/C9H8N4O5/c1-4(9(14)15)10-5-2-3-6(13(16)17)8-7(5)11-18-12-8/h2-4,10H,1H3,(H,14,15)
• InChIKey: KWAIYUDRTUOOPG-UHFFFAOYSA-N

Properties

• Density: 1.658g/cm³ (Cal.)
• Boiling point: 543.948°C at 760 mmHg (Cal.)
• Flash point: 282.77°C (Cal.)