Ethyl (S)-1,3-Dihydro-alpha-[(4-Nitrophenyl)Methyl]-1,3-Dioxo-2H-Isoindole-2-Acetate
[CAS# 17451-67-1]

Identification

• Name: Ethyl (S)-1,3-Dihydro-alpha-[(4-Nitrophenyl)Methyl]-1,3-Dioxo-2H-Isoindole-2-Acetate
• Synonyms: Ethyl 2-(1,3-Dioxoisoindolin-2-Yl)-3-(4-Nitrophenyl)Propanoate; 2-(1,3-Dioxo-2-Isoindolinyl)-3-(4-Nitrophenyl)Propanoic Acid Ethyl Ester; 2-(1,3-Diketoisoindolin-2-Yl)-3-(4-Nitrophenyl)Propionic Acid Ethyl Ester
• Molecular Formula: C₁₉H₁₆N₂O₆
• Molecular Weight: 368.35
• CAS Registry Number: 17451-67-1
• EINECS: 241-468-8
• SMILES: C1=CC(=CC=C1[N+]([O-])=O)CC(N2C(C3=C(C2=O)C=CC=C3)=O)C(=O)OCC
• InChI: 1S/C19H16N2O6/c1-2-27-19(24)16(11-12-7-9-13(10-8-12)21(25)26)20-17(22)14-5-3-4-6-15(14)18(20)23/h3-10,16H,2,11H2,1H3
• InChIKey: RVEIAMZETABDBE-UHFFFAOYSA-N

Properties

• Density: 1.397g/cm³ (Cal.)
• Boiling point: 547.995°C at 760 mmHg (Cal.)
• Flash point: 285.217°C (Cal.)