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2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile

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2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile Basic information

Product Name:
2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile
Synonyms:
  • 2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile
  • 2-Malononitrilyl- 1-(2-fluorophenyl)ethanone
  • Propanedinitrile,2-[2-(2-fluorophenyl)-2-oxoethyl]-
  • TAK-438( Vonoprazan fumarate) intermediate 1
  • 2-(2-(2-fluorophenyl)-2-oxoethyl)malononitrile
  • Vonoprazan Fumarate impurity 1
  • Vonoprazan Impurity 32
  • TAK438 Impurity 31
CAS:
312307-38-3
MF:
C11H7FN2O
MW:
202.18
Product Categories:
  • 312307-38-3
Mol File:
312307-38-3.mol
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2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile Chemical Properties

Boiling point:
399.8±37.0 °C(Predicted)
Density 
1.249±0.06 g/cm3(Predicted)
storage temp. 
2-8°C
Appearance
Off-white to light brown Solid
InChI
InChI=1S/C11H7FN2O/c12-10-4-2-1-3-9(10)11(15)5-8(6-13)7-14/h1-4,8H,5H2
InChIKey
NOUFLZSMHQHSHA-UHFFFAOYSA-N
SMILES
C(#N)C(CC(C1=CC=CC=C1F)=O)C#N
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2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile Usage And Synthesis

Uses

[2-(2-Fluorophenyl)-2-oxoethyl]-propanedinitrile (Vonoprazan Impurity 32) is an impurity of Vonoprazan, a potassium-competitive acid blocker (P-CAB) that suppresses gastric acid secretion.

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