| Identification | Back Directory | [Name]
1H-Imidazole-5-carboxylic acid, 1-methyl-4-[methyl[[(5-oxohexyl)amino]carbonyl]amino]- | [CAS]
84321-40-4 | [Synonyms]
Pentoxifylline Impurity 15
Pentoxifylline Impurity 13
1H-Imidazole-5-carboxylic acid, 1-methyl-4-[methyl[[(5-oxohexyl)amino]carbonyl]amino]- | [Molecular Formula]
C13H20N4O4 | [MOL File]
84321-40-4.mol | [Molecular Weight]
296.32 |
| Chemical Properties | Back Directory | [Boiling point ]
642.3±55.0 °C(Predicted) | [density ]
1.28±0.1 g/cm3(Predicted) | [pka]
-0.49±0.25(Predicted) | [InChI]
InChI=1S/C13H20N4O4/c1-9(18)6-4-5-7-14-13(21)17(3)11-10(12(19)20)16(2)8-15-11/h8H,4-7H2,1-3H3,(H,14,21)(H,19,20) | [InChIKey]
VBOSZPMTSNGBNM-UHFFFAOYSA-N | [SMILES]
C1N(C)C(C(O)=O)=C(N(C)C(NCCCCC(=O)C)=O)N=1 |
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