4-(2,5-Dimethyl-1H-Pyrrol-1-Yl)-Benzoic Acid
[CAS# 15898-26-7]

Identification

• Name: 4-(2,5-Dimethyl-1H-Pyrrol-1-Yl)-Benzoic Acid
• Synonyms: 4-(2,5-Dimethyl-1-Pyrrolyl)Benzoate; Zinc00083790
• Molecular Formula: C₁₃H₁₂NO₂
• Molecular Weight: 214.24
• CAS Registry Number: 15898-26-7
• SMILES: C1=C(C)[N](C(=C1)C)C2=CC=C(C=C2)C(=O)[O-]
• InChI: 1S/C13H13NO2/c1-9-3-4-10(2)14(9)12-7-5-11(6-8-12)13(15)16/h3-8H,1-2H3,(H,15,16)/p-1
• InChIKey: WNZAIUIEXCYTCY-UHFFFAOYSA-M

Properties

• Boiling point: 383.803°C at 760 mmHg (Cal.)
• Flash point: 185.918°C (Cal.)