ChemicalBook--->CAS DataBase List--->112559-81-6

112559-81-6

112559-81-6 Structure

112559-81-6 Structure
IdentificationMore
[Name]

4-(4-(4-Nitrophenyl)-1-piperazinyl)phenol
[CAS]

112559-81-6
[Synonyms]

1-(4-HYDROXYPHENYL)-4-(4-NITROPHENYL)-PIPERAZINE
[EINECS(EC#)]

601-189-8
[Molecular Formula]

C16H17N3O3
[MDL Number]

MFCD08460988
[Molecular Weight]

299.32
[MOL File]

112559-81-6.mol
Chemical PropertiesBack Directory
[Melting point ]

>90°C (dec.)
[Boiling point ]

540.8±50.0 °C(Predicted)
[density ]

1.317±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

DMSO (Slightly, Heated)
[form ]

Solid
[pka]

12.18±0.30(Predicted)
[color ]

Yellow to Brown
[InChI]

InChI=1S/C16H17N3O3/c20-16-7-5-14(6-8-16)18-11-9-17(10-12-18)13-1-3-15(4-2-13)19(21)22/h1-8,20H,9-12H2
[InChIKey]

BNHYDULILNJFFY-UHFFFAOYSA-N
[SMILES]

C1(O)=CC=C(N2CCN(C3=CC=C([N+]([O-])=O)C=C3)CC2)C=C1
[CAS DataBase Reference]

112559-81-6(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

4-[4-(4-Nitrophenyl)-1-piperazinyl]phenol is a key intermediate in the synthesis of triazole medicines, such as itraconazole (I937500), which are used in curing deep department fungal infections. Inhibitor of endothelial cell proliferation.
[Uses]

4-[4-(4-Nitrophenyl)-1-piperazinyl]phenol is a key intermediate in the synthesis of triazole medicines, used in curing deep department fungal infections. Inhibitor of endothelial cell proliferation.
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