3-Carbamoyl-2-(4-Methoxyphenyl)Propanoic Acid
[CAS# 5468-16-6]

Identification

• Name: 3-Carbamoyl-2-(4-Methoxyphenyl)Propanoic Acid
• Synonyms: 4-Amino-2-(4-Methoxyphenyl)-4-Oxo-Butanoic Acid; 4-Amino-4-Keto-2-(4-Methoxyphenyl)Butyric Acid; Oprea1_702960
• Molecular Formula: C₁₁H₁₃NO₄
• Molecular Weight: 223.23
• CAS Registry Number: 5468-16-6
• SMILES: C1=CC(=CC=C1C(C(=O)O)CC(N)=O)OC
• InChI: 1S/C11H13NO4/c1-16-8-4-2-7(3-5-8)9(11(14)15)6-10(12)13/h2-5,9H,6H2,1H3,(H2,12,13)(H,14,15)
• InChIKey: DCRYCSHWUVYXNX-UHFFFAOYSA-N

Properties

• Density: 1.272g/cm³ (Cal.)
• Boiling point: 482.415°C at 760 mmHg (Cal.)
• Flash point: 245.556°C (Cal.)