2-Acetamido-N-benzoylalanine
[CAS# 876488-77-6]

Identification

• Name: 2-Acetamido-N-benzoylalanine
• Synonyms: 2-acetamido-2-benzamidopropanoic acid
• Molecular Formula: C₁₂H₁₄N₂O₄
• Molecular Weight: 250.25
• CAS Registry Number: 876488-77-6
• SMILES: CC(=O)NC(C)(C(=O)O)NC(=O)C1=CC=CC=C1
• InChI: 1S/C12H14N2O4/c1-8(15)13-12(2,11(17)18)14-10(16)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,13,15)(H,14,16)(H,17,18)
• InChIKey: NNXQIQVJUVQVOF-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 598.8±45.0°C at 760 mmHg (Cal.)
• Flash point: 316.0±28.7°C (Cal.)
• Refractive index: 1.561 (Cal.)