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O-(7-氮杂苯并三唑-1-基)-N,N,N',N'-四甲基脲六氟磷酸盐
2-(7-Aza-1H-Benzotriazole-1-yl)-1,1,3,3-Tetramethyluronium Hexafluorophosphate
化合物简介
HATU (1-[Bis(dimethylamino)methylene]-1H-1,2,3-triazolo[4,5-b]pyridinium 3-oxid hexafluorophosphate) is a reagent used in peptide coupling chemistry to generate an active ester from a carboxylic acid. HATU is used along with Hünig's base (N,N-diisopropylethylamine, DIPEA) to form amide bonds. Generally DMF is used as solvent, although other polar organic solvents can also be used.
基本信息
CAS:148893-10-1
中文别名:HATU;2-(7-氮杂苯并三氮唑)-四甲基脲六氟磷酸盐;
英文别名:O-(7-Azabenzotriazol-1-yl)-N,N,N,N-tetramethyl uronium hexafluorophosphate;[dimethylamino(triazolo[4,5-b]pyridin-3-yloxy)methylidene]-dimethylazanium,hexafluorophosphate;2-(7-Aza-1H-benzotriazole-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphate;O-(7-Azabenzotriazol-1-yl)-N,N,N\',N\'-tetramethyluronium hexafluorophosphate;2-(7-Aza-1H-Benzotriazo;N,N,N\',N\'-Tetramethyl-O-(7-azabenzotriazol-1-yl)uronium hexafluorophosphate;
分子式:C10H15F6N6OP
分子量:380.23
精确质量:380.095
Psa:72.67
Logp:2.827
中文别名:HATU;2-(7-氮杂苯并三氮唑)-四甲基脲六氟磷酸盐;
英文别名:O-(7-Azabenzotriazol-1-yl)-N,N,N,N-tetramethyl uronium hexafluorophosphate;[dimethylamino(triazolo[4,5-b]pyridin-3-yloxy)methylidene]-dimethylazanium,hexafluorophosphate;2-(7-Aza-1H-benzotriazole-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphate;O-(7-Azabenzotriazol-1-yl)-N,N,N\',N\'-tetramethyluronium hexafluorophosphate;2-(7-Aza-1H-Benzotriazo;N,N,N\',N\'-Tetramethyl-O-(7-azabenzotriazol-1-yl)uronium hexafluorophosphate;
分子式:C10H15F6N6OP
分子量:380.23
精确质量:380.095
Psa:72.67
Logp:2.827
编号系统
MDL号:MFCD00274639
物化性质
外观与性状:白色晶体粉末
沸点:176ºC at 760mmHg
熔点:183-188°C (dec.)
储存条件:2-8ºC
沸点:176ºC at 760mmHg
熔点:183-188°C (dec.)
储存条件:2-8ºC
安全信息
安全说明:S26-S37/39-S36/37
WGK Germany:3
危险类别码:R36/37/38
危险品标志:Xi
WGK Germany:3
危险类别码:R36/37/38
危险品标志:Xi
生产方法及用途
合成路线
上游原料
下游产品
图谱
Predict 1H proton NMR
![](https://imgs.chem-site.com/ytupu/148893-10-1/1144482.png)
13C NMR : Predict
![](https://imgs.chem-site.com/ytupu/148893-10-1/1144483.png)
1H NMR : Predict
![](https://imgs.chem-site.com/ytupu/148893-10-1/1144484.png)