5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde

5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde Basic information
Product Name:5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde
Synonyms:1H-Pyrrole-3-carboxaldehyde, 5-(2-fluorophenyl)-;5-(2-fluorophenyl)-1H-pyrrole-3-carbaldehyde;5-(2-Fluorophenyl)-1H-pyrrole-3-carbal...;5-(2-Fluorophenyl)-1H-pyrrole-3-carboxaldehyde;1H-Pyrrole-3-carboxaldehyde, 5-(2-fluorophenyl)-1H-pyrrole-;TAK438 Impurity 54;1H-Pyrrole-3-carboxaldehyde, 5-(2-fluorophenyl)-1H-pyrrole-3-carbaldehyde;TAK-438( Vonoprazan fumarate) intermediate 3
CAS:881674-56-2
MF:C11H8FNO
MW:189.19
EINECS:809-913-6
Product Categories:Vonoprazan;Pharmaceutical Intermediates;881674-56-2
Mol File:881674-56-2.mol
5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde Structure
5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde Chemical Properties
Melting point 133 °C
Boiling point 370.6±32.0 °C(Predicted)
density 1.270±0.06 g/cm3(Predicted)
storage temp. under inert gas (nitrogen or Argon) at 2-8°C
solubility Chloroform (Slightly, Sonicated), DMSO (Slightly), Methanol (Slightly)
form Solid
pka14.77±0.50(Predicted)
color Light Brown to Brown
Stability:Hygroscopic
InChIInChI=1S/C11H8FNO/c12-10-4-2-1-3-9(10)11-5-8(7-14)6-13-11/h1-7,13H
InChIKeyMQULPEUCGKEHEG-UHFFFAOYSA-N
SMILESN1C(C2=CC=CC=C2F)=CC(C=O)=C1
Safety Information
HS Code 2933998090
MSDS Information
5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde Usage And Synthesis
Chemical PropertiesLight orange to Yellow to Green powder to crystal.
Uses5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde acts as a reagent in the synthetic preparation of novel pyrrole derivatives as potassium-competitive acid blocker (P-CAB).
Application5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde is a potassium ion-competitive acid blocker used in therapy Acid-related diseases, gastric ulcer, duodenal ulcer, reflux esophagitis, etc.
PreparationSynthesis of 5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde: Using pyrrole as raw material, after being protected by N-alkylation of triisopropylsilyl chloride, it is then reacted with Vilsmeier reagent to obtain 1H-Pyrrole-3-carbaldehyde, which is then purified by N-bromosuccinimide (NBS) bromination and 2-fluorophenylboronic acid for Suzuki coupling reaction to obtain crude 5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde, which was purified with toluene. The total yield was 35.5%.
5-(2-Fluorophenyl)-1H-pyrrole-3-carbaldehyde Preparation Products And Raw materials
Raw materials2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile-->5-(2-fluorophenyl)-1H-pyrrole-3-carbonitrile
Preparation Products4-fluoro-5-(2-fluorophenyl)-1H-pyrrole-3-carbaldehyde
1H-Pyrrole-3-carboxaldehyde, 5-(2-fluorophenyl)-1-(3-pyridinylsulfonyl)- 1-(5-(2-fluorophenyl)-1H-pyrrol-3-yl)-N-methylmethanamine 1-methylpyridin-1-ium-4-sulfonate 5-Methyl-2-phenyl-1,2-dihydropyrazol-3-one 1H-Pyrrole-3-carbonitrile,5-(2-fluorophenyl)-1-(3-pyridinylsulfonyl)- 3-N,N-dimethylsulfamoylpyridine PD 0332991 HCl Vonoprazan 1-(2-chloro-5-(2-fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl)-N-methylmethanamine Flupirtine maleate 6-broMo-2-chloro-8-cyclopentyl-5-Methylpyrido[2,3-d]pyriMidin-7(8H)-one TAK-438 4-[[(4-Fluorophenyl)imino]methyl]-phenol 5-chloropyridine-3-sulfonyl chloride pyridine-3-sulfonyl chloride Vonoprazan Fumarate impurity (4S)-3-[(5R)-5-(4-FLUOROPHENYL)-5-HYDROXYPENTANOYL]-4-PHENYL-1,3-OXAZOLIDIN-2-ONE Ezetimibe

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