2,5-Dimethyl-1-(3-Methoxyphenyl)-1H-Pyrrole-3-Acetic Acid
[CAS# 42780-28-9]

Identification

• Name: 2,5-Dimethyl-1-(3-Methoxyphenyl)-1H-Pyrrole-3-Acetic Acid
• Synonyms: 2-[1-(3-Methoxyphenyl)-2,5-Dimethyl-Pyrrol-3-Yl]Acetic Acid; 2-[1-(3-Methoxyphenyl)-2,5-Dimethyl-3-Pyrrolyl]Acetic Acid; 2-[1-(3-Methoxyphenyl)-2,5-Dimethyl-Pyrrol-3-Yl]Ethanoic Acid
• Molecular Formula: C₁₅H₁₇NO₃
• Molecular Weight: 259.30
• CAS Registry Number: 42780-28-9
• SMILES: C1=C([N](C(=C1CC(=O)O)C)C2=CC=CC(=C2)OC)C
• InChI: 1S/C15H17NO3/c1-10-7-12(8-15(17)18)11(2)16(10)13-5-4-6-14(9-13)19-3/h4-7,9H,8H2,1-3H3,(H,17,18)
• InChIKey: BMEJSSRLGVPEHW-UHFFFAOYSA-N

Properties

• Density: 1.146g/cm³ (Cal.)
• Boiling point: 447.102°C at 760 mmHg (Cal.)
• Flash point: 224.199°C (Cal.)