1-[4-(1H-Pyrrol-1-yl)phenyl]ethanone

CAS: 22106-37-2

Ref. 3D-FP114446

Product Information

• Name: 1-[4-(1H-Pyrrol-1-yl)phenyl]ethanone
• Synonyms: Ethanone, 1-[4-(1H-pyrrol-1-yl)phenyl]-
• CAS: 22106-37-2

Description

1-[4-(1H-Pyrrol-1-yl)phenyl]ethanone is a derivative of an aromatic amine that has been used in the synthesis of rofecoxib. It is a choline salt with a chloride group at the 4 position on the phenyl ring and a connect group at the 3 position. This compound has been shown to be pharmacologically active against various types of cancer cells and may be used as an alternative to rofecoxib, which was removed from the market due to its adverse cardiovascular effects. 1-[4-(1H-Pyrrol-1-yl)phenyl]ethanone is biodegradable and reusable, making it an environmentally friendly alternative to other amines such as choline chloride.

• Brand: Biosynth

Chemical properties

• Molecular weight: 185.22 g/mol
• Formula: C₁₂H₁₁NO
• Purity: Min. 95%
• InChI: InChI=1S/C12H11NO/c1-10(14)11-4-6-12(7-5-11)13-8-2-3-9-13/h2-9H,1H3
• InChI key: InChIKey=DXDGPUOOPJCGOL-UHFFFAOYSA-N
• SMILES: CC(=O)c1ccc(-n2cccc2)cc1