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HomeProduct name list5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile

5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile

  • CAS NO.:1240948-77-9
  • Empirical Formula: C11H7FN2
  • Molecular Weight: 186.19
  • MDL number: MFCD24619247
  • EINECS: 809-912-0
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-11-14 14:09:35
5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile Structural

What is 5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile?

Description

5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile is an important pharmaceutical intermediate component for the preparation of vonorasan fumarate, vonoprazan key intermediate, and vorexanol fumarate intermediate.

The Uses of 5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile

5-(2-Fluorophenyl)-1H-pyrrole-3-carbonitrile is an impurity of Vonoprazan (V767010) a novel potassium-competitive acid blocker for the treatment of acid-related diseases.

Properties of 5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile

Boiling point: 364.7±32.0 °C(Predicted)
Density  1.28±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
pka 13.87±0.50(Predicted)
form  Solid
Dielectric constant 5.5(22.0℃)
InChI InChI=1S/C11H7FN2/c12-10-4-2-1-3-9(10)11-5-8(6-13)7-14-11/h1-5,7,14H

Safety information for 5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for 5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile

InChIKey ZDEFHFJZEDEKJO-UHFFFAOYSA-N
SMILES N1C(C2=CC=CC=C2F)=CC(C#N)=C1

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