(5-Nitro-1,3-Dioxo-1,3-Dihydro-2H-Isoindol-2-Yl)Acetic Acid
[CAS# 10133-88-7]

Identification

• Name: (5-Nitro-1,3-Dioxo-1,3-Dihydro-2H-Isoindol-2-Yl)Acetic Acid
• Synonyms: 2-(5-Nitro-1,3-Dioxo-Isoindolin-2-Yl)Acetate; 2-(5-Nitro-1,3-Dioxo-2-Isoindolinyl)Acetate; 2-(1,3-Diketo-5-Nitro-Isoindolin-2-Yl)Acetate
• Molecular Formula: C₁₀H₅N₂O₆
• Molecular Weight: 249.16
• CAS Registry Number: 10133-88-7
• SMILES: C1=C([N+]([O-])=O)C=CC2=C1C(=O)N(C2=O)CC([O-])=O
• InChI: 1S/C10H6N2O6/c13-8(14)4-11-9(15)6-2-1-5(12(17)18)3-7(6)10(11)16/h1-3H,4H2,(H,13,14)/p-1
• InChIKey: IYUGAIHDSMCVCC-UHFFFAOYSA-M

Properties

• Boiling point: 504.502°C at 760 mmHg (Cal.)
• Flash point: 258.914°C (Cal.)