2-[(2S)-3-Acetyl-4-Hydroxy-2-(4-Methylphenyl)-5-Oxo-2H-Pyrrol-1-Yl]Acetic acid
[CAS# 332022-22-7]

Identification

• Name: 2-[(2S)-3-Acetyl-4-Hydroxy-2-(4-Methylphenyl)-5-Oxo-2H-Pyrrol-1-Yl]Acetic acid
• Synonyms: 2-[(5S)-4-Acetyl-3-Hydroxy-2-Keto-5-(4-Methylphenyl)-3-Pyrrolin-1-Yl]Acetate; 2-[(2S)-3-Ethanoyl-4-Hydroxy-2-(4-Methylphenyl)-5-Oxo-2H-Pyrrol-1-Yl]Ethanoate; Zinc04638164
• Molecular Formula: C₁₅H₁₄NO₅
• Molecular Weight: 288.28
• CAS Registry Number: 332022-22-7
• SMILES: [C@H]1(N(C(=O)C(=C1C(=O)C)O)CC([O-])=O)C2=CC=C(C=C2)C
• InChI: 1S/C15H15NO5/c1-8-3-5-10(6-4-8)13-12(9(2)17)14(20)15(21)16(13)7-11(18)19/h3-6,13,20H,7H2,1-2H3,(H,18,19)/p-1/t13-/m0/s1
• InChIKey: RRYYQPHSPLNZJB-ZDUSSCGKSA-M

Properties

• Boiling point: 596.644°C at 760 mmHg (Cal.)
• Flash point: 314.639°C (Cal.)