基本信息
- 标准SMILES
CN(C)C(On1nnc2cccnc21)=[N+](C)C- InChIKey
WXIONIWNXBAHRU-UHFFFAOYSA-N- 分子式
- C10H15N6O+
- 平均分子量
- 235.27 g/mol
- 单同位素质量
- 235.13073412
名称与标识
- 首选名称
- (Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium
- IUPAC
- [dimethylamino(triazolo[4,5-b]pyridin-3-yloxy)methylidene]-dimethylazanium
名称与别名
DTXSID901026947200731-30-2(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminiumRefChem:1050860DTXCID801003174[dimethylamino(triazolo[4,5-b]pyridin-3-yloxy)methylidene]-dimethylazaniumMethanaminium,N-[(dimethylamino)(3H-1,2,3-triazolo[4,5-b]pyridin-3-yloxy)methylene]-N-methyl-, hexafluorophosphate(1-)SCHEMBL11981SCHEMBL241113SCHEMBL29359375SCHEMBL29442809
展开更多名称
WXIONIWNXBAHRU-UHFFFAOYSA-NBP-12319NS001265057-azabenzotriazol-1-yl-N,N,N',N'tetramethyluronium7-azabenzotriazol-1-yl-N,N,N',N'-tetramethyluroniumO-(7-azabenzotriazol-1-yl)-N,N,N',N'-tetramethyluroniumO-(7-azabenzotriazole-1yl)-N,N,N',N'-tetramethyluronium2-(7-aza-1h-benzotriazole-1-yl)-1,1,3,3-tetramethyluronium
数据库标识
- CAS
200731-30-2- PubChem CID
- 4641409
- DTXSID
DTXSID901026947- Nikkaji
- J1.330.076C、J578.463H
性质
结构计算性质
- XLogP
- 0.7
- 极性表面积
- 59.1 Ų
- 氢键供体
- 0
- 氢键受体
- 4
- 可旋转键
- 3
- 重原子
- 17
- 形式电荷
- 1
- 复杂度
- 288
相关反应
2,807 条
关联笔记
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