4-[(2-Acetamido-3-Phenylprop-2-Enoyl)Amino]Butanoic Acid
[CAS# 172798-49-1]

Identification

• Name: 4-[(2-Acetamido-3-Phenylprop-2-Enoyl)Amino]Butanoic Acid
• Synonyms: 4-[[(Z)-2-Acetamido-3-Phenylprop-2-Enoyl]Amino]Butanoic Acid; 4-[(2-Acetamido-3-Phenyl-Prop-2-Enoyl)Amino]Butanoic Acid; 4-[[(Z)-2-Acetamido-3-Phenyl-Prop-2-Enoyl]Amino]Butanoic Acid
• Molecular Formula: C₁₅H₁₈N₂O₄
• Molecular Weight: 290.32
• CAS Registry Number: 172798-49-1
• SMILES: C1=C(/C=C(/C(NCCCC(O)=O)=O)NC(C)=O)C=CC=C1
• InChI: 1S/C15H18N2O4/c1-11(18)17-13(10-12-6-3-2-4-7-12)15(21)16-9-5-8-14(19)20/h2-4,6-7,10H,5,8-9H2,1H3,(H,16,21)(H,17,18)(H,19,20)/b13-10-
• InChIKey: PAMUSRDIXABYTA-RAXLEYEMSA-N

Properties

• Density: 1.231g/cm³ (Cal.)
• Boiling point: 662.642°C at 760 mmHg (Cal.)
• Flash point: 354.553°C (Cal.)