3-(2,5-Dimethyl-1H-Pyrrol-1-Yl)-4-Methylbenzoic Acid
[CAS# 313701-78-9]

Identification

• Name: 3-(2,5-Dimethyl-1H-Pyrrol-1-Yl)-4-Methylbenzoic Acid
• Synonyms: 3-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-methyl-; 3-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-methyl-benzoic acid; 3-(2,5-dimethylpyrrolyl)-4-methylbenzoic acid
• Molecular Formula: C₁₄H₁₅NO₂
• Molecular Weight: 229.27
• CAS Registry Number: 313701-78-9
• SMILES: O=C(O)c1ccc(c(c1)n2c(ccc2C)C)C
• InChI: 1S/C14H15NO2/c1-9-4-7-12(14(16)17)8-13(9)15-10(2)5-6-11(15)3/h4-8H,1-3H3,(H,16,17)
• InChIKey: ALKSDHRUSDCLSX-UHFFFAOYSA-N

Properties

• Density: 1.125g/cm³ (Cal.)
• Boiling point: 422.003°C at 760 mmHg (Cal.)
• Flash point: 209.02°C (Cal.)
• Refractive index: 1.572 (Cal.)