3-[[4-(Carboxymethylcarbamoyl)Phenyl]Carbamoyl]Prop-2-Enoic Acid
[CAS# 83560-90-1]

Identification

• Name: 3-[[4-(Carboxymethylcarbamoyl)Phenyl]Carbamoyl]Prop-2-Enoic Acid
• Synonyms: 4-[[4-(Carboxymethylcarbamoyl)Phenyl]Amino]-4-Oxobut-2-Enoic Acid; (E)-4-[[4-(Carboxymethylcarbamoyl)Phenyl]Amino]-4-Oxo-But-2-Enoic Acid; 4-[[4-(Carboxymethylcarbamoyl)Phenyl]Amino]-4-Oxo-But-2-Enoic Acid
• Molecular Formula: C₁₃H₁₂N₂O₆
• Molecular Weight: 292.25
• CAS Registry Number: 83560-90-1
• SMILES: C1=C(C=CC(=C1)NC(=O)\C=C\C(O)=O)C(=O)NCC(O)=O
• InChI: 1S/C13H12N2O6/c16-10(5-6-11(17)18)15-9-3-1-8(2-4-9)13(21)14-7-12(19)20/h1-6H,7H2,(H,14,21)(H,15,16)(H,17,18)(H,19,20)/b6-5+
• InChIKey: LXWLHBPEOKDYLU-AATRIKPKSA-N

Properties

• Density: 1.497g/cm³ (Cal.)
• Boiling point: 705.692°C at 760 mmHg (Cal.)
• Flash point: 380.589°C (Cal.)