2-[(1-Ethyl-2-Methyl-1H-Indol-3-Yl)Carbonyl]-3-Pyridinecarboxylic Acid
[CAS# 69898-42-6]

Identification

• Name: 2-[(1-Ethyl-2-Methyl-1H-Indol-3-Yl)Carbonyl]-3-Pyridinecarboxylic Acid
• Synonyms: 2-(1-Ethyl-2-Methyl-Indole-3-Carbonyl)Pyridine-3-Carboxylic Acid; 2-[(1-Ethyl-2-Methyl-3-Indolyl)-Oxomethyl]-3-Pyridinecarboxylic Acid; 2-(1-Ethyl-2-Methyl-Indole-3-Carbonyl)Nicotinic Acid
• Molecular Formula: C₁₈H₁₆N₂O₃
• Molecular Weight: 308.34
• CAS Registry Number: 69898-42-6
• SMILES: C1=CC2=C(C=C1)C(=C([N]2CC)C)C(=O)C3=C(C=CC=N3)C(=O)O
• InChI: 1S/C18H16N2O3/c1-3-20-11(2)15(12-7-4-5-9-14(12)20)17(21)16-13(18(22)23)8-6-10-19-16/h4-10H,3H2,1-2H3,(H,22,23)
• InChIKey: HGLISOFZJUBYPD-UHFFFAOYSA-N

Properties

• Density: 1.272g/cm³ (Cal.)
• Boiling point: 550.482°C at 760 mmHg (Cal.)
• Flash point: 286.722°C (Cal.)