(1,3-Dioxo-3,4-Dihydroisoquinolin-2(1H)-Yl)Acetic Acid
[CAS# 52208-61-4]

Identification

• Name: (1,3-Dioxo-3,4-Dihydroisoquinolin-2(1H)-Yl)Acetic Acid
• Synonyms: 2-(1,3-Diketo-4H-Isoquinolin-2-Yl)Acetate; 2-(1,3-Dioxo-4H-Isoquinolin-2-Yl)Ethanoate; Zinc01404630
• Molecular Formula: C₁₁H₈NO₄
• Molecular Weight: 218.19
• CAS Registry Number: 52208-61-4
• SMILES: C1=CC=CC2=C1C(=O)N(C(=O)C2)CC([O-])=O
• InChI: 1S/C11H9NO4/c13-9-5-7-3-1-2-4-8(7)11(16)12(9)6-10(14)15/h1-4H,5-6H2,(H,14,15)/p-1
• InChIKey: PNBCSFDZKNXAAK-UHFFFAOYSA-M

Properties

• Boiling point: 500.791°C at 760 mmHg (Cal.)
• Flash point: 256.67°C (Cal.)