| Identification | Back Directory | [Name]
4-(5-(Pyridin-3-yl)-1H-1,2,4-triazol-3-yl)picolinonitrile | [CAS]
2044706-68-3 | [Synonyms]
Tuobisite Impurity 37
Topiroxostat Impurity 66
4-(5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)picolinonitrile
4-(5-(Pyridin-3-yl)-1H-1,2,4-triazol-3-yl)picolinonitrile
2-Pyridinecarbonitrile, 4-[5-(3-pyridinyl)-1H-1,2,4-triazol-3-yl]- | [Molecular Formula]
C13H8N6 | [MDL Number]
MFCD30609534 | [MOL File]
2044706-68-3.mol | [Molecular Weight]
248.24 |
| Chemical Properties | Back Directory | [Boiling point ]
586.4±60.0 °C(Predicted) | [density ]
1.45±0.1 g/cm3(Predicted) | [pka]
6.39±0.12(Predicted) | [InChI]
InChI=1S/C13H8N6/c14-7-11-6-9(3-5-16-11)12-17-13(19-18-12)10-2-1-4-15-8-10/h1-6,8H,(H,17,18,19) | [InChIKey]
QLVSBNUTPJHDRB-UHFFFAOYSA-N | [SMILES]
C1(C#N)=NC=CC(C2N=C(C3=CC=CN=C3)NN=2)=C1 |
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