2-[1-(4-Chlorophenyl)-2-Methyl-5-(4-Methylphenyl)Pyrrol-3-Yl]Acetic Acid
[CAS# 42780-06-3]

Identification

• Name: 2-[1-(4-Chlorophenyl)-2-Methyl-5-(4-Methylphenyl)Pyrrol-3-Yl]Acetic Acid
• Synonyms: 2-[1-(4-Chlorophenyl)-2-Methyl-5-(4-Methylphenyl)-3-Pyrrolyl]Acetic Acid; 2-[1-(4-Chlorophenyl)-2-Methyl-5-(4-Methylphenyl)Pyrrol-3-Yl]Ethanoic Acid; Brn 0432684
• Molecular Formula: C₂₀H₁₈ClNO₂
• Molecular Weight: 339.82
• CAS Registry Number: 42780-06-3
• SMILES: C1=C([N](C(=C1CC(=O)O)C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C
• InChI: 1S/C20H18ClNO2/c1-13-3-5-15(6-4-13)19-11-16(12-20(23)24)14(2)22(19)18-9-7-17(21)8-10-18/h3-11H,12H2,1-2H3,(H,23,24)
• InChIKey: XMZIJZRQONCISB-UHFFFAOYSA-N

Properties

• Density: 1.205g/cm³ (Cal.)
• Boiling point: 515.11°C at 760 mmHg (Cal.)
• Flash point: 265.329°C (Cal.)