2-Acetamido-5-Phenyl-Pentanoic Acid
[CAS# 5440-44-8]

Identification

• Name: 2-Acetamido-5-Phenyl-Pentanoic Acid
• Synonyms: 2-Acetamido-5-Phenyl-Pentanoic Acid; 2-Acetamido-5-Phenyl-Valeric Acid; Nsc20167
• Molecular Formula: C₁₃H₁₇NO₃
• Molecular Weight: 235.28
• CAS Registry Number: 5440-44-8
• SMILES: C1=CC=CC=C1CCCC(NC(C)=O)C(=O)O
• InChI: 1S/C13H17NO3/c1-10(15)14-12(13(16)17)9-5-8-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-9H2,1H3,(H,14,15)(H,16,17)
• InChIKey: NATYAPACRIEJOH-UHFFFAOYSA-N

Properties

• Density: 1.144g/cm³ (Cal.)
• Boiling point: 506.432°C at 760 mmHg (Cal.)
• Flash point: 260.081°C (Cal.)