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439097-58-2

439097-58-2 Structure

439097-58-2 Structure
IdentificationBack Directory
[Name]

1-(2-fluoro-4-nitrophenyl)piperidin-4-one
[CAS]

439097-58-2
[Synonyms]

1-(2-Fluoro-4-nitrophenyl)-4-piperidone
1-(2-fluoro-4-nitrophenyl)piperidin-4-one
4-Piperidinone, 1-(2-fluoro-4-nitrophenyl)-
[Molecular Formula]

C11H11FN2O3
[MDL Number]

MFCD03012687
[MOL File]

439097-58-2.mol
[Molecular Weight]

238.215
Chemical PropertiesBack Directory
[Boiling point ]

417.2±45.0 °C(Predicted)
[density ]

1.367±0.06 g/cm3(Predicted)
[form ]

Solid
[pka]

0.62±0.40(Predicted)
[InChI]

1S/C11H11FN2O3/c12-10-7-8(14(16)17)1-2-11(10)13-5-3-9(15)4-6-13/h1-2,7H,3-6H2
[InChIKey]

BMXFDVAJYBTGRC-UHFFFAOYSA-N
[SMILES]

O=C(CC1)CCN1C2=C(F)C=C([N+]([O-])=O)C=C2
[CAS DataBase Reference]

439097-58-2
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HS Code ]

2933399990
[Storage Class]

11 - Combustible Solids
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