2-(Carboxymethyl)-5-(4-Chlorobenzoyl)-1,4-Dimethylpyrrole-3-Carboxylic Acid
[CAS# 33369-28-7]

Identification

• Name: 2-(Carboxymethyl)-5-(4-Chlorobenzoyl)-1,4-Dimethylpyrrole-3-Carboxylic Acid
• Synonyms: 2-(Carboxymethyl)-5-(4-Chlorobenzoyl)-1,4-Dimethyl-Pyrrole-3-Carboxylic Acid; 2-(Carboxymethyl)-5-[(4-Chlorophenyl)-Oxomethyl]-1,4-Dimethyl-3-Pyrrolecarboxylic Acid; 2-(Carboxymethyl)-5-(4-Chlorophenyl)Carbonyl-1,4-Dimethyl-Pyrrole-3-Carboxylic Acid
• Molecular Formula: C₁₆H₁₄ClNO₅
• Molecular Weight: 335.74
• CAS Registry Number: 33369-28-7
• EINECS: 251-471-6
• SMILES: C2=C(C(C1=C(C(=C([N]1C)CC(=O)O)C(=O)O)C)=O)C=CC(=C2)Cl
• InChI: 1S/C16H14ClNO5/c1-8-13(16(22)23)11(7-12(19)20)18(2)14(8)15(21)9-3-5-10(17)6-4-9/h3-6H,7H2,1-2H3,(H,19,20)(H,22,23)
• InChIKey: DPCBHULRLBCPAE-UHFFFAOYSA-N

Properties

• Density: 1.411g/cm³ (Cal.)
• Boiling point: 567.562°C at 760 mmHg (Cal.)
• Flash point: 297.051°C (Cal.)