CAS 40167-37-1

4-Phenyl-1H-pyrrole-3-carbonitrile

Description:

4-Phenyl-1H-pyrrole-3-carbonitrile is an organic compound characterized by its pyrrole ring structure, which is a five-membered aromatic heterocycle containing nitrogen. The presence of a phenyl group at the 4-position and a cyano group at the 3-position contributes to its unique chemical properties. This compound typically exhibits moderate solubility in organic solvents and may show limited solubility in water due to its hydrophobic phenyl group. It is often utilized in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. The cyano group can participate in various chemical reactions, such as nucleophilic additions or cycloadditions, making it a versatile building block in synthetic chemistry. Additionally, the compound may exhibit interesting biological activities, although specific biological data would depend on empirical studies. As with many organic compounds, safety precautions should be taken when handling it, as it may pose health risks if ingested or inhaled.

Formula: C₁₁H₈N₂

InChI: InChI=1S/C11H8N2/c12-6-10-7-13-8-11(10)9-4-2-1-3-5-9/h1-5,7-8,13H

InChI key: InChIKey=BMMCNKYHQAKJBN-UHFFFAOYSA-N

SMILES: C(#N)C=1C(=CNC1)C2=CC=CC=C2

Synonyms:

• 4-Phenyl-1H-pyrrole-3-carbonitrile
• 4-Phenylpyrrole-3-carbonitrile
• 3-Phenyl-4-cyanopyrrole
• 1H-Pyrrole-3-carbonitrile, 4-phenyl-
• 3-Cyano-4-phenylpyrrole

4-Phenyl-1H-pyrrole-3-carbonitrile

CAS: 40167-37-1

Formula: C₁₁H₈N₂

Molecular weight: 168.1946

Ref: IN-DA00CS1W

4-Phenyl-1H-pyrrole-3-carbonitrile

CAS: 40167-37-1

4-Phenyl-1H-pyrrole-3-carbonitrile is an acrylonitrile derivative that is a fungicide. It is used to control fungal diseases on plants and to prevent the spread of fungi in commercial buildings. The compound is used as a seed treatment and as a foliar spray. 4-Phenyl-1H-pyrrole-3-carbonitrile has been shown to be effective against many types of fungi, including species of Aspergillus, Alternaria, Cladosporium, Fusarium, Penicillium, Rhizopus, Scopulariopsis and Trichoderma. However it has little or no activity against bacteria or viruses. This fungicide can be absorbed through the skin and may cause kidney damage if ingested in large quantities.

Formula: C₁₁H₈N₂

Purity: Min. 95%

Molecular weight: 168.19 g/mol

Ref: 3D-QBA16737