Ethyl 2-Acetamido-3-(4-Nitrophenyl)Propanoate
[CAS# 198152-46-4]

Identification

• Name: Ethyl 2-Acetamido-3-(4-Nitrophenyl)Propanoate
• Synonyms: 2-Acetamido-3-(4-Nitrophenyl)Propanoic Acid Ethyl Ester; 2-Acetamido-3-(4-Nitrophenyl)Propionic Acid Ethyl Ester; N-Acetyl-Dl-(4-Nitrophenyl)Alanine Ethyl Ester
• Molecular Formula: C₁₃H₁₆N₂O₅
• Molecular Weight: 280.28
• CAS Registry Number: 198152-46-4
• SMILES: C1=C([N+]([O-])=O)C=CC(=C1)CC(NC(C)=O)C(=O)OCC
• InChI: 1S/C13H16N2O5/c1-3-20-13(17)12(14-9(2)16)8-10-4-6-11(7-5-10)15(18)19/h4-7,12H,3,8H2,1-2H3,(H,14,16)
• InChIKey: BWHLPNOCAMQFBD-UHFFFAOYSA-N

Properties

• Density: 1.238g/cm³ (Cal.)
• Boiling point: 489.631°C at 760 mmHg (Cal.)
• Flash point: 249.92°C (Cal.)

Safety Data

• Safety Description: R 36/37/38 S 26-36/37