2,5-Dimethyl-1-(4-Methylphenyl)-1H-Pyrrole-3-Acetic acid
[CAS# 42779-84-0]

Identification

• Name: 2,5-Dimethyl-1-(4-Methylphenyl)-1H-Pyrrole-3-Acetic acid
• Synonyms: 2-[2,5-Dimethyl-1-(4-Methylphenyl)-3-Pyrrolyl]Acetate; 2-[2,5-Dimethyl-1-(4-Methylphenyl)Pyrrol-3-Yl]Ethanoate; Zinc03888870
• Molecular Formula: C₁₅H₁₆NO₂
• Molecular Weight: 242.30
• CAS Registry Number: 42779-84-0
• SMILES: C1=C([N](C(=C1CC([O-])=O)C)C2=CC=C(C=C2)C)C
• InChI: 1S/C15H17NO2/c1-10-4-6-14(7-5-10)16-11(2)8-13(12(16)3)9-15(17)18/h4-8H,9H2,1-3H3,(H,17,18)/p-1
• InChIKey: UUVCVTSSMHFGDP-UHFFFAOYSA-M

Properties

• Boiling point: 415.475°C at 760 mmHg (Cal.)
• Flash point: 205.072°C (Cal.)