2-([5-(Ethoxycarbonyl)-1-Methyl-1H-Pyrrol-3-Yl]Carbonyl)Benzenecarboxylic Acid
[CAS# 120562-90-5]

Identification

• Name: 2-([5-(Ethoxycarbonyl)-1-Methyl-1H-Pyrrol-3-Yl]Carbonyl)Benzenecarboxylic Acid
• Synonyms: 2-(5-Ethoxycarbonyl-1-Methyl-Pyrrole-3-Carbonyl)Benzoate; 2-[(5-Ethoxycarbonyl-1-Methyl-3-Pyrrolyl)-Oxomethyl]Benzoate; 2-(5-Carbethoxy-1-Methyl-Pyrrole-3-Carbonyl)Benzoate
• Molecular Formula: C₁₆H₁₄NO₅
• Molecular Weight: 300.29
• CAS Registry Number: 120562-90-5
• SMILES: C1=C(C=C([N]1C)C(OCC)=O)C(=O)C2=CC=CC=C2C([O-])=O
• InChI: 1S/C16H15NO5/c1-3-22-16(21)13-8-10(9-17(13)2)14(18)11-6-4-5-7-12(11)15(19)20/h4-9H,3H2,1-2H3,(H,19,20)/p-1
• InChIKey: NSBVSILGKAWZDW-UHFFFAOYSA-M

Properties

• Boiling point: 526.242°C at 760 mmHg (Cal.)
• Flash point: 272.061°C (Cal.)