ChemicalBook--->CAS DataBase List--->287964-59-4

287964-59-4

287964-59-4 Structure

287964-59-4 Structure
IdentificationBack Directory
[Name]

Cyanotemozolomide
[CAS]

287964-59-4
[Synonyms]

Cyano TeMozoMide
Cyanotemozolomide
Temozolomide Impurity G
Cyanotemozolomide, >=98%
Temozolomide Impurity 24
1,4-Dihydro-3-nitro-4-oxo-imidazo[5,1-c][1,2,4]triazine-8-carboxamide
IMidazo[5,1-c][1,2,4]triazine-8-carboxaMide,1,4-dihydro-3-nitro-4-oxo-
3-Methyl-4-oxo-3,4-dihydroimidazo[5,1-d][1,2,3,5]tetrazine-8-carbonitrile
[Molecular Formula]

C6H4N6O
[MDL Number]

MFCD09263700
[MOL File]

287964-59-4.mol
[Molecular Weight]

176.14
Chemical PropertiesBack Directory
[Boiling point ]

704.2±52.0 °C(Predicted)
[density ]

2.38±0.1 g/cm3(Predicted)
[pka]

14.41±0.20(Predicted)
[InChI]

InChI=1S/C6H4N6O4/c7-3(13)2-4-9-10-5(12(15)16)6(14)11(4)1-8-2/h1,9H,(H2,7,13)
[InChIKey]

UPMXYTFKFBVAEM-UHFFFAOYSA-N
[SMILES]

N1=C([N+]([O-])=O)C(=O)N2C=NC(C(N)=O)=C2N1
Hazard InformationBack Directory
[Uses]

Cyanotemozolomide is a derivative of temozolomide (T01775), which is an antineoplastic agent.
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