Ethyl 4-(4-Chlorophenyl)-1H-Pyrrole-3-Carboxylate
[CAS# 122453-97-8]

Identification

• Name: Ethyl 4-(4-Chlorophenyl)-1H-Pyrrole-3-Carboxylate
• Synonyms: 4-(4-Chloro-phenyl)-1H-pyrrole-3-carboxylic acid ethyl ester; Ethyl 4-(4-chlorophenyl)pyrrole-3-carboxylate; Pyrrolnitrin der.
• Molecular Formula: C₁₃H₁₂ClNO₂
• Molecular Weight: 249.69
• CAS Registry Number: 122453-97-8
• SMILES: CCOC(=O)C1=CNC=C1C2=CC=C(C=C2)Cl
• InChI: 1S/C13H12ClNO2/c1-2-17-13(16)12-8-15-7-11(12)9-3-5-10(14)6-4-9/h3-8,15H,2H2,1H3
• InChIKey: RQSAOSHNBJFBJS-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 451.1±40.0°C at 760 mmHg (Cal.)
• Flash point: 226.6±27.3°C (Cal.)
• Refractive index: 1.582 (Cal.)