2-[1-(4-Bromophenyl)-2,5-Dimethyl-Pyrrol-3-Yl]Acetic Acid
[CAS# 42780-23-4]

Identification

• Name: 2-[1-(4-Bromophenyl)-2,5-Dimethyl-Pyrrol-3-Yl]Acetic Acid
• Synonyms: 2-[1-(4-Bromophenyl)-2,5-Dimethyl-Pyrrol-3-Yl]Acetic Acid; 2-[1-(4-Bromophenyl)-2,5-Dimethyl-3-Pyrrolyl]Acetic Acid; 2-[1-(4-Bromophenyl)-2,5-Dimethyl-Pyrrol-3-Yl]Ethanoic Acid
• Molecular Formula: C₁₄H₁₄BrNO₂
• Molecular Weight: 308.17
• CAS Registry Number: 42780-23-4
• SMILES: C1=C([N](C(=C1CC(=O)O)C)C2=CC=C(C=C2)Br)C
• InChI: 1S/C14H14BrNO2/c1-9-7-11(8-14(17)18)10(2)16(9)13-5-3-12(15)4-6-13/h3-7H,8H2,1-2H3,(H,17,18)
• InChIKey: RKZFEYDWVDEQTM-UHFFFAOYSA-N

Properties

• Density: 1.419g/cm³ (Cal.)
• Boiling point: 443.925°C at 760 mmHg (Cal.)
• Flash point: 222.278°C (Cal.)