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865758-95-8

865758-95-8 Structure

865758-95-8 Structure
IdentificationBack Directory
[Name]

2-[(6-CHLORO-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)METHYL]BENZONITRILE
[CAS]

865758-95-8
[Synonyms]

Alogliptin-5
ALOGLIPTIN int2
alogliptin impurities10
alogliptin impurities157
Alogliptin Related Compound 27
Agger coluMn dean interMediates
Alogliptin 6-Chloro N-Desmethyl Impurity
Benzonitrile, 2-[(6-chloro-3,4-dihydro-2,4-dioxo-1(2H)-pyrim...
2-[(6-CHLORO-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)METHYL]BENZONITRILE
2-((6-Chloro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)methyl)benzonitrile
2-[(6-Chloro-3,4-dihydro-2,4-dioxo-1(2H)-pyriMidinyl)Methyl]-benzonitrile
Benzonitrile, 2-[(6-chloro-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)methyl]-
Alogliptin impurity 9/2-((6-Chloro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)methyl)benzonitrile
[Molecular Formula]

C12H8ClN3O2
[MDL Number]

MFCD09907853
[MOL File]

865758-95-8.mol
[Molecular Weight]

261.66
Chemical PropertiesBack Directory
[density ]

1.48
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[solubility ]

Dichloromethane, Ethyl Acetate, Methanol
[form ]

Solid
[pka]

8.11±0.40(Predicted)
[color ]

White
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

2-((6-Chloro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)methyl)benzonitrile is used as a reactant/ intermediate in discovery of Alogliptin (A575425), which is an antidiabetic agent.
[Uses]

Alogliptin (A575425) intermediate.
Spectrum DetailBack Directory
[Spectrum Detail]

2-[(6-CHLORO-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)METHYL]BENZONITRILE(865758-95-8)1HNMR
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