基本信息
- 标准SMILES
CN(C)C(On1nnc2ccccc21)=[N+](C)C- InChIKey
CLZISMQKJZCZDN-UHFFFAOYSA-N- 分子式
- C11H16N5O+
- 平均分子量
- 234.28 g/mol
- 单同位素质量
- 234.13548515
名称与标识
- 首选名称
- O-benzotriazol-1-yl-tetramethyluronium
- IUPAC
- [benzotriazol-1-yloxy(dimethylamino)methylidene]-dimethylazanium
名称与别名
O-benzotriazol-1-yl-tetramethyluroniumBC3YQ8JNG8SCHEMBL78773SCHEMBL118552SCHEMBL29544944SCHEMBL30378712CLZISMQKJZCZDN-UHFFFAOYSA-N[benzotriazol-1-yloxy(dimethylamino)methylidene]-dimethylazaniumNCGC00184705-01NS00002466O-benzotriazol-1-yl-N,N,N',N'-tetramethyluroniumO-(benzotriazol-1-yl)-1,1,3,3-tetramethyluronium
展开更多名称
O-benzotriazol-1-yl-N,N, N',N'-tetramethyluronium2-(1h-benzotriazole-1-yl)1,1,3,3-tetramethyluroniumO-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium2-(1H-benzotriazol-1-yl)-1,1,3,3-tetramethyluroniumO-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium[(benzotriazol-1-yloxy)-dimethylamino methylene]-dimethyl-ammonium[(Benzotriazol-1-yloxy)-dimethylamino-methylene]-dimethyl-ammoniumMethanaminium, N-[(1H-benzotriazol-1-yloxy)(dimethylamino)methylene]-N-methyl-
数据库标识
- CAS
221036-98-2- PubChem CID
- 130500
- UNII
- BC3YQ8JNG8
- Nikkaji
- J489.755B、J845.158C
性质
结构计算性质
- XLogP
- 1.4
- 极性表面积
- 46.2 Ų
- 氢键供体
- 0
- 氢键受体
- 3
- 可旋转键
- 3
- 重原子
- 17
- 形式电荷
- 1
- 复杂度
- 287
相关反应
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