ChemicalBook--->CAS DataBase List--->312307-38-3

312307-38-3

312307-38-3 Structure

312307-38-3 Structure
IdentificationBack Directory
[Name]

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

312307-38-3
[Synonyms]

Vonoprazan-2
Vonoprazan-028
TAK438 Impurity 31
Vonoprazan Impuirty 63
Vonoprazan Impurity 32
Vonoprazan Fumarate impurity 1
2-Malononitrilyl- 1-(2-fluorophenyl)ethanone
TAK-438( Vonoprazan fumarate) intermediate 1
2-(2-(2-fluorophenyl)-2-oxoethyl)malononitrile
2-(2-Fluorophenyl)-2-oxoethyl]-propanedinitrile
2-[2-(2-fluorophenyl)2-oxyethyl]propanedinitrile
2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile
Propanedinitrile,2-[2-(2-fluorophenyl)-2-oxoethyl]-
2-(2-(2-fluorophenyl)-2-oxoethyl)malononitrile (Vonoprazan Impurity)
2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile ISO 9001:2015 REACH
Vonoprazan impurity 35/2-(2-(2-fluorophenyl)-2-oxoethyl)malononitrile
Vonoprazan impurity SM2-H: 2- [2- (2-fluorophenyl) -2-oxoethyl] malononitrile
[Molecular Formula]

C11H7FN2O
[MDL Number]

MFCD28404602
[MOL File]

312307-38-3.mol
[Molecular Weight]

202.18
Chemical PropertiesBack Directory
[Boiling point ]

399.8±37.0 °C(Predicted)
[density ]

1.249±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,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
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[REACH Registrations]

Active
Hazard InformationBack Directory
[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.
Spectrum DetailBack Directory
[Spectrum Detail]

2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile(312307-38-3)1HNMR
2-[2-(2-Fluorophenyl)-2-oxoethyl]propanedinitrile(312307-38-3)1HNMR
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