3-(2,4-dimethyl-1H-pyrrol-3-yl)benzoic acid
[CAS# 775322-46-8]

Identification

• Name: 3-(2,4-dimethyl-1H-pyrrol-3-yl)benzoic acid
• Synonyms: 3-(2,4-dimethyl-1H-pyrrol-3-yl)benzoic acid
• Molecular Formula: C₁₃H₁₃NO₂
• Molecular Weight: 215.25
• CAS Registry Number: 775322-46-8
• SMILES: Cc2cnc(C)c2c1cc(ccc1)C(O)=O
• InChI: 1S/C13H13NO2/c1-8-7-14-9(2)12(8)10-4-3-5-11(6-10)13(15)16/h3-7,14H,1-2H3,(H,15,16)
• InChIKey: DKSOEJHXZLDIAS-UHFFFAOYSA-N

Properties

• Density: 1.208g/cm³ (Cal.)
• Boiling point: 405.282°C at 760 mmHg (Cal.)
• Flash point: 198.907°C (Cal.)
• Refractive index: 1.611 (Cal.)