Diethyl 2-Acetamido-2-[(2-Methylphenyl)Methyl]Propanedioate
[CAS# 5440-53-9]

Identification

• Name: Diethyl 2-Acetamido-2-[(2-Methylphenyl)Methyl]Propanedioate
• Synonyms: 2-Acetamido-2-[(2-Methylphenyl)Methyl]Propanedioic Acid Diethyl Ester; 2-Acetamido-2-(2-Methylbenzyl)Malonic Acid Diethyl Ester; St5449210
• Molecular Formula: C₁₇H₂₃NO₅
• Molecular Weight: 321.37
• CAS Registry Number: 5440-53-9
• SMILES: C1=CC=CC(=C1CC(NC(=O)C)(C(OCC)=O)C(=O)OCC)C
• InChI: 1S/C17H23NO5/c1-5-22-15(20)17(18-13(4)19,16(21)23-6-2)11-14-10-8-7-9-12(14)3/h7-10H,5-6,11H2,1-4H3,(H,18,19)
• InChIKey: MLOGBFRWXSOGML-UHFFFAOYSA-N

Properties

• Density: 1.133g/cm³ (Cal.)
• Boiling point: 466.44°C at 760 mmHg (Cal.)
• Flash point: 235.895°C (Cal.)