CAS 857283-60-4

1-(4-Isocyanatophenyl)-1H-pyrrole

Description:

1-(4-Isocyanatophenyl)-1H-pyrrole, identified by its CAS number 857283-60-4, is an organic compound characterized by the presence of both isocyanate and pyrrole functional groups. This compound typically exhibits a molecular structure that includes a pyrrole ring, which is a five-membered aromatic heterocycle containing nitrogen, and a phenyl group substituted with an isocyanate (-N=C=O) functional group. The isocyanate moiety is known for its reactivity, particularly in forming urethane linkages through reactions with alcohols or amines. This compound may be utilized in various applications, including the synthesis of polymers, coatings, and pharmaceuticals, due to its potential for cross-linking and reactivity. Additionally, the presence of the pyrrole ring may impart unique electronic properties, making it of interest in materials science and organic electronics. Safety considerations should be taken into account when handling this compound, as isocyanates can be hazardous and require appropriate protective measures.

Formula: C₁₁H₈N₂O

InChI: InChI=1/C11H8N2O/c14-9-12-10-3-5-11(6-4-10)13-7-1-2-8-13/h1-8H

InChI key: InChIKey=XZPOEEDBGHTYQC-UHFFFAOYSA-N

SMILES: N(=C=O)C1=CC=C(C=C1)N2C=CC=C2

Synonyms:

• 1-(4-Isocyanatophenyl)-1H-pyrrole
• 1H-Pyrrole, 1-(4-isocyanatophenyl)-

1-(4-Isocyanatophenyl)-1H-pyrrole

CAS: 857283-60-4

1-(4-Isocyanatophenyl)-1H-pyrrole

Purity: 97%

Color and Shape: White Solid

Molecular weight: 184.19g/mol

Ref: 54-OR6721