(4-Alanylphenyl)acetic acid
[CAS# 806595-80-2]

Identification

• Name: (4-Alanylphenyl)acetic acid
• Synonyms: 2-(4-(2-aminopropanoyl)phenyl)acetic acid; BENZENEACETICACID, 4-(2-AMINO-1-OXOPROPYL)-
• Molecular Formula: C₁₁H₁₃NO₃
• Molecular Weight: 207.23
• CAS Registry Number: 806595-80-2
• SMILES: CC(C(=O)c1ccc(cc1)CC(=O)O)N
• InChI: 1S/C11H13NO3/c1-7(12)11(15)9-4-2-8(3-5-9)6-10(13)14/h2-5,7H,6,12H2,1H3,(H,13,14)
• InChIKey: PGBZDKRRUJWCPJ-UHFFFAOYSA-N

Properties

• Density: 1.226g/cm³ (Cal.)
• Boiling point: 414.698°C at 760 mmHg (Cal.)
• Flash point: 204.602°C (Cal.)
• Refractive index: 1.571 (Cal.)